Isothiocyanates
Isothiocyanates
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Filtered Search Results
tert-Butyl isothiocyanate, 97%, Thermo Scientific Chemicals
CAS: 590-42-1 Molecular Formula: C5H9NS Molecular Weight (g/mol): 115.19 MDL Number: MFCD00004816 InChI Key: ZFWFRTVIIMTOLY-UHFFFAOYSA-N Synonym: tert-butyl isothiocyanate,t-butyl isothiocyanate,propane, 2-isothiocyanato-2-methyl,tert-butylisothiocyanate,tert.-butyl isothiocyanate,2-isothiocyanato-2-methyl-propane,tert butyl isothiocyanate,tert-butyliso thiocyanate,butyl isothiocyanate, tert,t-butylisothiocyanate PubChem CID: 11544 IUPAC Name: 2-isothiocyanato-2-methylpropane SMILES: CC(C)(C)N=C=S
PubChem CID | 11544 |
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CAS | 590-42-1 |
Molecular Weight (g/mol) | 115.19 |
MDL Number | MFCD00004816 |
SMILES | CC(C)(C)N=C=S |
Synonym | tert-butyl isothiocyanate,t-butyl isothiocyanate,propane, 2-isothiocyanato-2-methyl,tert-butylisothiocyanate,tert.-butyl isothiocyanate,2-isothiocyanato-2-methyl-propane,tert butyl isothiocyanate,tert-butyliso thiocyanate,butyl isothiocyanate, tert,t-butylisothiocyanate |
IUPAC Name | 2-isothiocyanato-2-methylpropane |
InChI Key | ZFWFRTVIIMTOLY-UHFFFAOYSA-N |
Molecular Formula | C5H9NS |
1-Hexyl isothiocyanate, 97%, Thermo Scientific Chemicals
CAS: 4404-45-9 Molecular Formula: C7H13NS Molecular Weight (g/mol): 143.248 MDL Number: MFCD00014445 InChI Key: WXYAXKKXIGHXDS-UHFFFAOYSA-N Synonym: hexyl isothiocyanate,n-hexyl isothiocyanate,hexane, 1-isothiocyanato,1-hexyl isothiocyanate,hexylisothiocyanate,isothiocyanic acid, hexyl ester,unii-2s7c3ga0z5,1-hexylisothiocyanate,1-isothiocyanato-hexane,hexanisothiocyanate PubChem CID: 78120 IUPAC Name: 1-isothiocyanatohexane SMILES: CCCCCCN=C=S
PubChem CID | 78120 |
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CAS | 4404-45-9 |
Molecular Weight (g/mol) | 143.248 |
MDL Number | MFCD00014445 |
SMILES | CCCCCCN=C=S |
Synonym | hexyl isothiocyanate,n-hexyl isothiocyanate,hexane, 1-isothiocyanato,1-hexyl isothiocyanate,hexylisothiocyanate,isothiocyanic acid, hexyl ester,unii-2s7c3ga0z5,1-hexylisothiocyanate,1-isothiocyanato-hexane,hexanisothiocyanate |
IUPAC Name | 1-isothiocyanatohexane |
InChI Key | WXYAXKKXIGHXDS-UHFFFAOYSA-N |
Molecular Formula | C7H13NS |
Cyclohexyl isothiocyanate, 98%, Thermo Scientific Chemicals
CAS: 1122-82-3 Molecular Formula: C7H11NS Molecular Weight (g/mol): 141.232 MDL Number: MFCD00003841 InChI Key: MZSJGCPBOVTKHR-UHFFFAOYSA-N Synonym: cyclohexyl isothiocyanate,cyclohexane, isothiocyanato,isothiocyanocyclohexane,cyclohexyl-isothiocyanat,isothiocyanic acid, cyclohexyl ester,cyclohexylisothiocyanate,cyclohexyl isothiocyanate, isothiocyanato,cyclohexyl-isothiocyanat german,isothiocyanato-cyclohexane,isothiocyanic acid cyclohexyl ester PubChem CID: 14289 IUPAC Name: isothiocyanatocyclohexane SMILES: C1CCC(CC1)N=C=S
PubChem CID | 14289 |
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CAS | 1122-82-3 |
Molecular Weight (g/mol) | 141.232 |
MDL Number | MFCD00003841 |
SMILES | C1CCC(CC1)N=C=S |
Synonym | cyclohexyl isothiocyanate,cyclohexane, isothiocyanato,isothiocyanocyclohexane,cyclohexyl-isothiocyanat,isothiocyanic acid, cyclohexyl ester,cyclohexylisothiocyanate,cyclohexyl isothiocyanate, isothiocyanato,cyclohexyl-isothiocyanat german,isothiocyanato-cyclohexane,isothiocyanic acid cyclohexyl ester |
IUPAC Name | isothiocyanatocyclohexane |
InChI Key | MZSJGCPBOVTKHR-UHFFFAOYSA-N |
Molecular Formula | C7H11NS |
4-Nitrophenyl isothiocyanate, 97%, Thermo Scientific Chemicals
CAS: 2131-61-5 Molecular Formula: C7H4N2O2S Molecular Weight (g/mol): 180.181 MDL Number: MFCD00007307 InChI Key: NXHSSIGRWJENBH-UHFFFAOYSA-N Synonym: 4-nitrophenyl isothiocyanate,4-nitrophenylisothiocyanate,p-nitrophenyl isothiocyanate,benzene, 1-isothiocyanato-4-nitro,isothiocyanic acid 4-nitrophenyl ester,1-isothiocyanato-4-nitro-benzene,4-nitrobenzenisothiocyanate,4-nitrophenyl isothiocyanate 25gr,pubchem13428,4nitrophenyl isothiocyanate PubChem CID: 75044 IUPAC Name: 1-isothiocyanato-4-nitrobenzene SMILES: C1=CC(=CC=C1N=C=S)[N+](=O)[O-]
PubChem CID | 75044 |
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CAS | 2131-61-5 |
Molecular Weight (g/mol) | 180.181 |
MDL Number | MFCD00007307 |
SMILES | C1=CC(=CC=C1N=C=S)[N+](=O)[O-] |
Synonym | 4-nitrophenyl isothiocyanate,4-nitrophenylisothiocyanate,p-nitrophenyl isothiocyanate,benzene, 1-isothiocyanato-4-nitro,isothiocyanic acid 4-nitrophenyl ester,1-isothiocyanato-4-nitro-benzene,4-nitrobenzenisothiocyanate,4-nitrophenyl isothiocyanate 25gr,pubchem13428,4nitrophenyl isothiocyanate |
IUPAC Name | 1-isothiocyanato-4-nitrobenzene |
InChI Key | NXHSSIGRWJENBH-UHFFFAOYSA-N |
Molecular Formula | C7H4N2O2S |
1-Heptyl isothiocyanate, 96%, Thermo Scientific™
CAS: 4426-83-9 Molecular Formula: C8H15NS Molecular Weight (g/mol): 157.275 MDL Number: MFCD00041138 InChI Key: LIPUQNPCPLDDBO-UHFFFAOYSA-N Synonym: heptyl isothiocyanate,heptane, 1-isothiocyanato,n-heptyl isothiocyanate,1-heptyl isothiocyanate,heptylisothiocyanate,n-heptylisothiocyanate,heptane,1-isothiocyanato,acmc-20aks1,1-dihydroxyboryl butane PubChem CID: 78152 IUPAC Name: 1-isothiocyanatoheptane SMILES: CCCCCCCN=C=S
PubChem CID | 78152 |
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CAS | 4426-83-9 |
Molecular Weight (g/mol) | 157.275 |
MDL Number | MFCD00041138 |
SMILES | CCCCCCCN=C=S |
Synonym | heptyl isothiocyanate,heptane, 1-isothiocyanato,n-heptyl isothiocyanate,1-heptyl isothiocyanate,heptylisothiocyanate,n-heptylisothiocyanate,heptane,1-isothiocyanato,acmc-20aks1,1-dihydroxyboryl butane |
IUPAC Name | 1-isothiocyanatoheptane |
InChI Key | LIPUQNPCPLDDBO-UHFFFAOYSA-N |
Molecular Formula | C8H15NS |
2-Chloroethyl isothiocyanate, 97%, Thermo Scientific Chemicals
CAS: 6099-88-3 Molecular Formula: C3H4ClNS Molecular Weight (g/mol): 121.582 MDL Number: MFCD00041125 InChI Key: ZUWFBQUHBOUPFK-UHFFFAOYSA-N Synonym: 2-chloroethyl isothiocyanate,2-chloroethylisothiocyanate,ethane, 1-chloro-2-isothiocyanato,sgxdlhbabrkth@,chloroethylisothiocyanate,acmc-1b2t4,beta-chloroethylisothiocyanate,beta-chloroethyl isothiocyanate,1-chloro-2-isothiocyanato-ethane,# PubChem CID: 138661 IUPAC Name: 1-chloro-2-isothiocyanatoethane SMILES: C(CCl)N=C=S
PubChem CID | 138661 |
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CAS | 6099-88-3 |
Molecular Weight (g/mol) | 121.582 |
MDL Number | MFCD00041125 |
SMILES | C(CCl)N=C=S |
Synonym | 2-chloroethyl isothiocyanate,2-chloroethylisothiocyanate,ethane, 1-chloro-2-isothiocyanato,sgxdlhbabrkth@,chloroethylisothiocyanate,acmc-1b2t4,beta-chloroethylisothiocyanate,beta-chloroethyl isothiocyanate,1-chloro-2-isothiocyanato-ethane,# |
IUPAC Name | 1-chloro-2-isothiocyanatoethane |
InChI Key | ZUWFBQUHBOUPFK-UHFFFAOYSA-N |
Molecular Formula | C3H4ClNS |
2-(Ethoxycarbonyl)phenyl isothiocyanate, 98+%, Thermo Scientific™
CAS: 99960-09-5 Molecular Formula: C10H9NO2S Molecular Weight (g/mol): 207.247 MDL Number: MFCD00041063 InChI Key: TYEPWLJHQLYWSR-UHFFFAOYSA-N Synonym: 2-ethoxycarbonylphenyl isothiocyanate,2-ethoxycarbonyl phenyl isothiocyanate,2-isothiocyanatobenzoic acid ethyl ester,2-isothiocyanato-benzoic acid ethyl ester,acmc-20aon5,#,2-ethoxycarbonylphenylisothiocyanate,ethyl 2-isothiocyanatobenzoate,isothiocyanatobenzoic acid ethyl ester,benzoic acid,2-isothiocyanato-,ethyl ester PubChem CID: 523235 IUPAC Name: ethyl 2-isothiocyanatobenzoate SMILES: CCOC(=O)C1=CC=CC=C1N=C=S
PubChem CID | 523235 |
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CAS | 99960-09-5 |
Molecular Weight (g/mol) | 207.247 |
MDL Number | MFCD00041063 |
SMILES | CCOC(=O)C1=CC=CC=C1N=C=S |
Synonym | 2-ethoxycarbonylphenyl isothiocyanate,2-ethoxycarbonyl phenyl isothiocyanate,2-isothiocyanatobenzoic acid ethyl ester,2-isothiocyanato-benzoic acid ethyl ester,acmc-20aon5,#,2-ethoxycarbonylphenylisothiocyanate,ethyl 2-isothiocyanatobenzoate,isothiocyanatobenzoic acid ethyl ester,benzoic acid,2-isothiocyanato-,ethyl ester |
IUPAC Name | ethyl 2-isothiocyanatobenzoate |
InChI Key | TYEPWLJHQLYWSR-UHFFFAOYSA-N |
Molecular Formula | C10H9NO2S |
1,4-Phenylene diisothiocyanate, 98%, Thermo Scientific Chemicals
CAS: 4044-65-9 Molecular Formula: C8H4N2S2 Molecular Weight (g/mol): 192.254 MDL Number: MFCD00004811 InChI Key: OMWQUXGVXQELIX-UHFFFAOYSA-N Synonym: bitoscanate,1,4-phenylene diisothiocyanate,jonit,p-phenylene diisothiocyanate,benzene, 1,4-diisothiocyanato,bitoscanat,bitoscanate inn,phenylene thiocyanate,bitoscanatum latin,1,4-phenylenediisothiocyanate PubChem CID: 19958 IUPAC Name: 1,4-diisothiocyanatobenzene SMILES: C1=CC(=CC=C1N=C=S)N=C=S
PubChem CID | 19958 |
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CAS | 4044-65-9 |
Molecular Weight (g/mol) | 192.254 |
MDL Number | MFCD00004811 |
SMILES | C1=CC(=CC=C1N=C=S)N=C=S |
Synonym | bitoscanate,1,4-phenylene diisothiocyanate,jonit,p-phenylene diisothiocyanate,benzene, 1,4-diisothiocyanato,bitoscanat,bitoscanate inn,phenylene thiocyanate,bitoscanatum latin,1,4-phenylenediisothiocyanate |
IUPAC Name | 1,4-diisothiocyanatobenzene |
InChI Key | OMWQUXGVXQELIX-UHFFFAOYSA-N |
Molecular Formula | C8H4N2S2 |
3-(Methylthio)propyl isothiocyanate, 98%, Thermo Scientific Chemicals
CAS: 505-79-3 Molecular Formula: C5H9NS2 Molecular Weight (g/mol): 147.254 MDL Number: MFCD00209521 InChI Key: LDKSCZJUIURGMW-UHFFFAOYSA-N Synonym: 3-methylthio propyl isothiocyanate,iberverin,3-methylthiopropyl isothiocyanate,ibervirin,propane, 1-isothiocyanato-3-methylthio,unii-ytt13bn94z,3-methylmercaptopropyl isothiocyanate,isothiocyanic acid, 3-methylthio propyl ester,1-isothiocyanato-3-methylthio propane,fema no. 3312 PubChem CID: 62351 IUPAC Name: 1-isothiocyanato-3-methylsulfanylpropane SMILES: CSCCCN=C=S
PubChem CID | 62351 |
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CAS | 505-79-3 |
Molecular Weight (g/mol) | 147.254 |
MDL Number | MFCD00209521 |
SMILES | CSCCCN=C=S |
Synonym | 3-methylthio propyl isothiocyanate,iberverin,3-methylthiopropyl isothiocyanate,ibervirin,propane, 1-isothiocyanato-3-methylthio,unii-ytt13bn94z,3-methylmercaptopropyl isothiocyanate,isothiocyanic acid, 3-methylthio propyl ester,1-isothiocyanato-3-methylthio propane,fema no. 3312 |
IUPAC Name | 1-isothiocyanato-3-methylsulfanylpropane |
InChI Key | LDKSCZJUIURGMW-UHFFFAOYSA-N |
Molecular Formula | C5H9NS2 |
Methyle3-isothiocyanatothiophene-2-carboxylate, 97%, Thermo Scientific™
CAS: 81321-10-0 Molecular Formula: C7H5NO2S2 Molecular Weight (g/mol): 199.24 MDL Number: MFCD00052589 InChI Key: RKBLURUDWDTMOB-UHFFFAOYSA-N Synonym: methyl 3-isothiocyanato-2-thiophenecarboxylate,3-isothiocyanato-2-thiophenecarboxylic acid methyl ester,2-thiophenecarboxylicacid, 3-isothiocyanato-, methyl ester,methyl 3-isoisothiocyanatothiophene-2-carboxylate PubChem CID: 2777461 IUPAC Name: methyl 3-isothiocyanatothiophene-2-carboxylate SMILES: COC(=O)C1=C(C=CS1)N=C=S
PubChem CID | 2777461 |
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CAS | 81321-10-0 |
Molecular Weight (g/mol) | 199.24 |
MDL Number | MFCD00052589 |
SMILES | COC(=O)C1=C(C=CS1)N=C=S |
Synonym | methyl 3-isothiocyanato-2-thiophenecarboxylate,3-isothiocyanato-2-thiophenecarboxylic acid methyl ester,2-thiophenecarboxylicacid, 3-isothiocyanato-, methyl ester,methyl 3-isoisothiocyanatothiophene-2-carboxylate |
IUPAC Name | methyl 3-isothiocyanatothiophene-2-carboxylate |
InChI Key | RKBLURUDWDTMOB-UHFFFAOYSA-N |
Molecular Formula | C7H5NO2S2 |
Benzyl isothiocyanate, 98%, Thermo Scientific Chemicals
CAS: 622-78-6 Molecular Formula: C8H7NS Molecular Weight (g/mol): 149.22 MDL Number: MFCD00004819 InChI Key: MDKCFLQDBWCQCV-UHFFFAOYSA-N Synonym: benzyl isothiocyanate,isothiocyanatomethyl benzene,benzyl mustard oil,benzylisothiocyanate,benzylsenfoel,tromacaps,tromalyt,urogran,isothiocyanic acid, benzyl ester,benzyl-isothiocyanate PubChem CID: 2346 ChEBI: CHEBI:17484 IUPAC Name: isothiocyanatomethylbenzene SMILES: C1=CC=C(C=C1)CN=C=S
PubChem CID | 2346 |
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CAS | 622-78-6 |
Molecular Weight (g/mol) | 149.22 |
ChEBI | CHEBI:17484 |
MDL Number | MFCD00004819 |
SMILES | C1=CC=C(C=C1)CN=C=S |
Synonym | benzyl isothiocyanate,isothiocyanatomethyl benzene,benzyl mustard oil,benzylisothiocyanate,benzylsenfoel,tromacaps,tromalyt,urogran,isothiocyanic acid, benzyl ester,benzyl-isothiocyanate |
IUPAC Name | isothiocyanatomethylbenzene |
InChI Key | MDKCFLQDBWCQCV-UHFFFAOYSA-N |
Molecular Formula | C8H7NS |
Methyle2-isothiocyanatobenzoate, 97%, Thermo Scientific™
CAS: 16024-82-1 Molecular Formula: C9H7NO2S Molecular Weight (g/mol): 193.22 MDL Number: MFCD00041062 InChI Key: UNXVHBOJSCWVCD-UHFFFAOYSA-N Synonym: 2-isothiocyanato-benzoic acid methyl ester,2-methoxycarbonylphenyl isothiocyanate,2-methoxycarbonyl phenyl isothiocyanate,benzoic acid,2-isothiocyanato-, methyl ester,benzoic acid, 2-isothiocyanato-, methyl ester,acmc-209dkr,methyl2-isothiocyanatobenzoate,methyl 2-isothiocyanato benzoate,methyl 2-isothiocyanatobenzenecarboxylate,2-isothiocyanatobenzoic acid methyl ester PubChem CID: 85243 IUPAC Name: methyl 2-isothiocyanatobenzoate SMILES: COC(=O)C1=CC=CC=C1N=C=S
PubChem CID | 85243 |
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CAS | 16024-82-1 |
Molecular Weight (g/mol) | 193.22 |
MDL Number | MFCD00041062 |
SMILES | COC(=O)C1=CC=CC=C1N=C=S |
Synonym | 2-isothiocyanato-benzoic acid methyl ester,2-methoxycarbonylphenyl isothiocyanate,2-methoxycarbonyl phenyl isothiocyanate,benzoic acid,2-isothiocyanato-, methyl ester,benzoic acid, 2-isothiocyanato-, methyl ester,acmc-209dkr,methyl2-isothiocyanatobenzoate,methyl 2-isothiocyanato benzoate,methyl 2-isothiocyanatobenzenecarboxylate,2-isothiocyanatobenzoic acid methyl ester |
IUPAC Name | methyl 2-isothiocyanatobenzoate |
InChI Key | UNXVHBOJSCWVCD-UHFFFAOYSA-N |
Molecular Formula | C9H7NO2S |
3-Carboxyphenyl isothiocyanate, 97%, Thermo Scientific Chemicals
CAS: 2131-63-7 Molecular Formula: C8H5NO2S Molecular Weight (g/mol): 179.193 MDL Number: MFCD00041367 InChI Key: PJRBPKOOGLKPFB-UHFFFAOYSA-N Synonym: 3-carboxyphenyl isothiocyanate,3-carboxyphenylisothiocyanate,benzoic acid, 3-isothiocyanato,benzoic acid,3-isothiocyanato,acmc-20an7x,m-carboxyphenyl isothiocyanate,3-isothiocyanato-benzoic acid,# PubChem CID: 75046 IUPAC Name: 3-isothiocyanatobenzoic acid SMILES: C1=CC(=CC(=C1)N=C=S)C(=O)O
PubChem CID | 75046 |
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CAS | 2131-63-7 |
Molecular Weight (g/mol) | 179.193 |
MDL Number | MFCD00041367 |
SMILES | C1=CC(=CC(=C1)N=C=S)C(=O)O |
Synonym | 3-carboxyphenyl isothiocyanate,3-carboxyphenylisothiocyanate,benzoic acid, 3-isothiocyanato,benzoic acid,3-isothiocyanato,acmc-20an7x,m-carboxyphenyl isothiocyanate,3-isothiocyanato-benzoic acid,# |
IUPAC Name | 3-isothiocyanatobenzoic acid |
InChI Key | PJRBPKOOGLKPFB-UHFFFAOYSA-N |
Molecular Formula | C8H5NO2S |
2-Phenylethyl isothiocyanate, 98%, Thermo Scientific Chemicals
CAS: 2257-09-2 Molecular Formula: C9H9NS Molecular Weight (g/mol): 163.24 MDL Number: MFCD00004821 InChI Key: IZJDOKYDEWTZSO-UHFFFAOYSA-N Synonym: 2-phenylethyl isothiocyanate,phenethyl isothiocyanate,phenylethyl isothiocyanate,2-isothiocyanatoethyl benzene,phenethyl mustard oil,phenylaethylsenfoel,benzene, 2-isothiocyanatoethyl,peitc,phenylethyl mustard oil,2-phenylethylisothiocyanate PubChem CID: 16741 ChEBI: CHEBI:351346 IUPAC Name: 2-isothiocyanatoethylbenzene SMILES: C1=CC=C(C=C1)CCN=C=S
PubChem CID | 16741 |
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CAS | 2257-09-2 |
Molecular Weight (g/mol) | 163.24 |
ChEBI | CHEBI:351346 |
MDL Number | MFCD00004821 |
SMILES | C1=CC=C(C=C1)CCN=C=S |
Synonym | 2-phenylethyl isothiocyanate,phenethyl isothiocyanate,phenylethyl isothiocyanate,2-isothiocyanatoethyl benzene,phenethyl mustard oil,phenylaethylsenfoel,benzene, 2-isothiocyanatoethyl,peitc,phenylethyl mustard oil,2-phenylethylisothiocyanate |
IUPAC Name | 2-isothiocyanatoethylbenzene |
InChI Key | IZJDOKYDEWTZSO-UHFFFAOYSA-N |
Molecular Formula | C9H9NS |
2,4-Dichlorophenyl isothiocyanate, 97%, Thermo Scientific Chemicals
CAS: 6590-96-1 Molecular Formula: C7H3Cl2NS Molecular Weight (g/mol): 204.07 MDL Number: MFCD00037827 InChI Key: WVBNZZHGECFCSH-UHFFFAOYSA-N Synonym: 2,4-dichlorophenyl isothiocyanate,2,4-dichlorophenylisothiocyanate,benzene,2,4-dichloro-1-isothiocyanato,benzene, 2,4-dichloro-1-isothiocyanato,2,4-dichlorobenzenisothiocyanate,acmc-1b3n1,tos-bb-1123,2,4-dichloro-1-isothiocyanato-benzene,# PubChem CID: 81066 IUPAC Name: 2,4-dichloro-1-isothiocyanatobenzene SMILES: ClC1=CC=C(N=C=S)C(Cl)=C1
PubChem CID | 81066 |
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CAS | 6590-96-1 |
Molecular Weight (g/mol) | 204.07 |
MDL Number | MFCD00037827 |
SMILES | ClC1=CC=C(N=C=S)C(Cl)=C1 |
Synonym | 2,4-dichlorophenyl isothiocyanate,2,4-dichlorophenylisothiocyanate,benzene,2,4-dichloro-1-isothiocyanato,benzene, 2,4-dichloro-1-isothiocyanato,2,4-dichlorobenzenisothiocyanate,acmc-1b3n1,tos-bb-1123,2,4-dichloro-1-isothiocyanato-benzene,# |
IUPAC Name | 2,4-dichloro-1-isothiocyanatobenzene |
InChI Key | WVBNZZHGECFCSH-UHFFFAOYSA-N |
Molecular Formula | C7H3Cl2NS |