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Aryl halides

Organic compounds that contain an aromatic ring with one or more hydrogen atoms replaced by a halogen atom; also known as haloarene or halogenoarene. Halogen atoms include bromine, chlorine, fluorine, iodine.
Aryl bromides (107)
Aryl chlorides (51)
Aryl iodides (26)
Aryl fluorides (5)

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1

5-Iodo-2-phenoxypyridine, ≥95%, Thermo Scientific™

CAS: 352018-92-9 Molecular Formula: C11H8INO Molecular Weight (g/mol): 297.095 MDL Number: MFCD02681952 InChI Key: JCEXQQNAXWYXRX-UHFFFAOYSA-N Synonym: 5-iodo-2-phenoxy-pyridine,pyridine,5-iodo-2-phenoxy PubChem CID: 2776503 IUPAC Name: 5-iodo-2-phenoxypyridine SMILES: C1=CC=C(C=C1)OC2=NC=C(C=C2)I

PubChem CID 2776503
CAS 352018-92-9
Molecular Weight (g/mol) 297.095
MDL Number MFCD02681952
SMILES C1=CC=C(C=C1)OC2=NC=C(C=C2)I
Synonym 5-iodo-2-phenoxy-pyridine,pyridine,5-iodo-2-phenoxy
IUPAC Name 5-iodo-2-phenoxypyridine
InChI Key JCEXQQNAXWYXRX-UHFFFAOYSA-N
Molecular Formula C11H8INO
2

4-Iodo-5-methyl-isoxazole, 97%, Thermo Scientific™

CAS: 7064-38-2 Molecular Formula: C28H36N4O6S2 Molecular Weight (g/mol): 588.74 MDL Number: MFCD06411541 InChI Key: GDARZPKSXSXRDC-JCMHNJIXNA-N Synonym: 4-iodo-5-methylisoxazole,4-iodo-5-methyl-isoxazole,isoxazole,4-iodo-5-methyl,isoxazole, 4-iodo-5-methyl PubChem CID: 2795461 SMILES: CCCN1C(=O)C(C#N)=C(C)C(\C=C2/SC(=S)N(CCCCCC(O)=O)C2=O)=C1N1CCCC(C1)C(=O)OCC

PubChem CID 2795461
CAS 7064-38-2
Molecular Weight (g/mol) 588.74
MDL Number MFCD06411541
SMILES CCCN1C(=O)C(C#N)=C(C)C(\C=C2/SC(=S)N(CCCCCC(O)=O)C2=O)=C1N1CCCC(C1)C(=O)OCC
Synonym 4-iodo-5-methylisoxazole,4-iodo-5-methyl-isoxazole,isoxazole,4-iodo-5-methyl,isoxazole, 4-iodo-5-methyl
InChI Key GDARZPKSXSXRDC-JCMHNJIXNA-N
Molecular Formula C28H36N4O6S2
3

2-bromo-5-(trifluoromethyl)-1,3,4-thiadiazole, Thermo Scientific™

CAS: 37461-61-3 Molecular Formula: C3BrF3N2S Molecular Weight (g/mol): 233.01 MDL Number: MFCD00015535 InChI Key: LGTVLLPQCMJOGT-UHFFFAOYSA-N PubChem CID: 12874685 IUPAC Name: 2-bromo-5-(trifluoromethyl)-1,3,4-thiadiazole SMILES: FC(F)(F)C1=NN=C(Br)S1

PubChem CID 12874685
CAS 37461-61-3
Molecular Weight (g/mol) 233.01
MDL Number MFCD00015535
SMILES FC(F)(F)C1=NN=C(Br)S1
IUPAC Name 2-bromo-5-(trifluoromethyl)-1,3,4-thiadiazole
InChI Key LGTVLLPQCMJOGT-UHFFFAOYSA-N
Molecular Formula C3BrF3N2S
5

3-Bromo-4H-chromen-4-one, 97%, Thermo Scientific™

CAS: 49619-82-1 Molecular Formula: C9H5BrO2 Molecular Weight (g/mol): 225.041 MDL Number: MFCD00017337 InChI Key: IQIGYNPOESZBDJ-UHFFFAOYSA-N Synonym: 3-bromochromone,3-bromo-4h-chromen-4-one,3-bromo-4-oxo-4h-1-benzopyran,3-bromo chromone,maybridge1_006104,acmc-209kh2,3-bromo-4h-chromen-4-one #,3-bromo-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one,3-bromo PubChem CID: 521256 IUPAC Name: 3-bromochromen-4-one SMILES: C1=CC=C2C(=C1)C(=O)C(=CO2)Br

PubChem CID 521256
CAS 49619-82-1
Molecular Weight (g/mol) 225.041
MDL Number MFCD00017337
SMILES C1=CC=C2C(=C1)C(=O)C(=CO2)Br
Synonym 3-bromochromone,3-bromo-4h-chromen-4-one,3-bromo-4-oxo-4h-1-benzopyran,3-bromo chromone,maybridge1_006104,acmc-209kh2,3-bromo-4h-chromen-4-one #,3-bromo-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one,3-bromo
IUPAC Name 3-bromochromen-4-one
InChI Key IQIGYNPOESZBDJ-UHFFFAOYSA-N
Molecular Formula C9H5BrO2
6

5-Bromo-1,3,4-thiadiazol-2-ylamine, 97%, Thermo Scientific™

CAS: 37566-39-5 Molecular Formula: C2H2BrN3S Molecular Weight (g/mol): 180.02 MDL Number: MFCD00464325 InChI Key: GLYQQFBHCFPEEU-UHFFFAOYSA-N Synonym: 2-amino-5-bromo-1,3,4-thiadiazole,5-bromo-1,3,4-thiadiazol-2-ylamine,2-amino-5-bromo-1,3,4 thiadiazole,1,3,4-thiadiazol-2-amine, 5-bromo,5-bromo-1,3,4-thiadiazole-2-amine,5-bromo-1,3,4-thiadiazole-2-ylamine,5-bromo-1,3,4 thiadiazol-2-ylamine,bromothiadiazolamine,pubchem20972,ksc496o1t PubChem CID: 3650883 IUPAC Name: 5-bromo-1,3,4-thiadiazol-2-amine SMILES: NC1=NN=C(Br)S1

PubChem CID 3650883
CAS 37566-39-5
Molecular Weight (g/mol) 180.02
MDL Number MFCD00464325
SMILES NC1=NN=C(Br)S1
Synonym 2-amino-5-bromo-1,3,4-thiadiazole,5-bromo-1,3,4-thiadiazol-2-ylamine,2-amino-5-bromo-1,3,4 thiadiazole,1,3,4-thiadiazol-2-amine, 5-bromo,5-bromo-1,3,4-thiadiazole-2-amine,5-bromo-1,3,4-thiadiazole-2-ylamine,5-bromo-1,3,4 thiadiazol-2-ylamine,bromothiadiazolamine,pubchem20972,ksc496o1t
IUPAC Name 5-bromo-1,3,4-thiadiazol-2-amine
InChI Key GLYQQFBHCFPEEU-UHFFFAOYSA-N
Molecular Formula C2H2BrN3S
7

3,5-dichloropyridazine, Thermo Scientific™

CAS: 1837-55-4 Molecular Formula: C4H2Cl2N2 Molecular Weight (g/mol): 148.97 MDL Number: MFCD10698048 InChI Key: JZSAUQMXKHBZEO-UHFFFAOYSA-N PubChem CID: 19959687 IUPAC Name: 3,5-dichloropyridazine SMILES: ClC1=CC(Cl)=NN=C1

PubChem CID 19959687
CAS 1837-55-4
Molecular Weight (g/mol) 148.97
MDL Number MFCD10698048
SMILES ClC1=CC(Cl)=NN=C1
IUPAC Name 3,5-dichloropyridazine
InChI Key JZSAUQMXKHBZEO-UHFFFAOYSA-N
Molecular Formula C4H2Cl2N2
9

5-Bromo-1H-benzimidazole, 97%, Thermo Scientific™

CAS: 4887-88-1 Molecular Formula: C7H5BrN2 Molecular Weight (g/mol): 197.04 MDL Number: MFCD00160001 InChI Key: GEDVWGDBMPJNEV-UHFFFAOYSA-N Synonym: 5-bromo-1h-benzimidazole,5-bromo-1h-benzo d imidazole,5-bromo-1h-1,3-benzodiazole,5-bromobenzimidazole,1h-benzimidazole, 5-bromo,5-bromo-3h-1,3-benzodiazole,6-bromobenzimidazole,5-bromo-benzimidazole,6-bromo benzimidazole,pubchem9618 PubChem CID: 785299 SMILES: BrC1=CC=C2N=CNC2=C1

PubChem CID 785299
CAS 4887-88-1
Molecular Weight (g/mol) 197.04
MDL Number MFCD00160001
SMILES BrC1=CC=C2N=CNC2=C1
Synonym 5-bromo-1h-benzimidazole,5-bromo-1h-benzo d imidazole,5-bromo-1h-1,3-benzodiazole,5-bromobenzimidazole,1h-benzimidazole, 5-bromo,5-bromo-3h-1,3-benzodiazole,6-bromobenzimidazole,5-bromo-benzimidazole,6-bromo benzimidazole,pubchem9618
InChI Key GEDVWGDBMPJNEV-UHFFFAOYSA-N
Molecular Formula C7H5BrN2
10

4-iodo-2-methyl-1H-imidazole, Thermo Scientific™

CAS: 73746-45-9 Molecular Formula: C4H5IN2 Molecular Weight (g/mol): 208.00 MDL Number: MFCD02684335 InChI Key: SEDSLMWYUQACGR-UHFFFAOYSA-N PubChem CID: 2794623 IUPAC Name: 5-iodo-2-methyl-1H-imidazole SMILES: CC1=NC=C(I)N1

PubChem CID 2794623
CAS 73746-45-9
Molecular Weight (g/mol) 208.00
MDL Number MFCD02684335
SMILES CC1=NC=C(I)N1
IUPAC Name 5-iodo-2-methyl-1H-imidazole
InChI Key SEDSLMWYUQACGR-UHFFFAOYSA-N
Molecular Formula C4H5IN2
11

5-Bromo-3-(chloromethyl)-1-benzothiophene, ≥97%, Thermo Scientific™

CAS: 852180-53-1 Molecular Formula: C9H6BrClS Molecular Weight (g/mol): 261.561 MDL Number: MFCD07772810 InChI Key: ZIOALKCKGFEWMX-UHFFFAOYSA-N PubChem CID: 7164583 IUPAC Name: 5-bromo-3-(chloromethyl)-1-benzothiophene SMILES: C1=CC2=C(C=C1Br)C(=CS2)CCl

PubChem CID 7164583
CAS 852180-53-1
Molecular Weight (g/mol) 261.561
MDL Number MFCD07772810
SMILES C1=CC2=C(C=C1Br)C(=CS2)CCl
IUPAC Name 5-bromo-3-(chloromethyl)-1-benzothiophene
InChI Key ZIOALKCKGFEWMX-UHFFFAOYSA-N
Molecular Formula C9H6BrClS
12

3-Chloro-5-(trifluoromethyl)pyridine, ≥97%, Thermo Scientific™

CAS: 85148-26-1 Molecular Formula: C6H3ClF3N Molecular Weight (g/mol): 181.54 MDL Number: MFCD00042227 InChI Key: OMRCXTBFBBWTDL-UHFFFAOYSA-N Synonym: 3-chloro-5-trifluoromethyl pyridine,3-trifluoromethyl-5-chloropyridine,pyridine, 3-chloro-5-trifluoromethyl,pubchem3552,acmc-209zee,ksc495c1f,3-chloro-5-trifluoromethyl-pyridine,3-chloro-5-trifluoromethyl pyridine-carbonitrile PubChem CID: 2736698 IUPAC Name: 3-chloro-5-(trifluoromethyl)pyridine SMILES: FC(F)(F)C1=CC(Cl)=CN=C1

PubChem CID 2736698
CAS 85148-26-1
Molecular Weight (g/mol) 181.54
MDL Number MFCD00042227
SMILES FC(F)(F)C1=CC(Cl)=CN=C1
Synonym 3-chloro-5-trifluoromethyl pyridine,3-trifluoromethyl-5-chloropyridine,pyridine, 3-chloro-5-trifluoromethyl,pubchem3552,acmc-209zee,ksc495c1f,3-chloro-5-trifluoromethyl-pyridine,3-chloro-5-trifluoromethyl pyridine-carbonitrile
IUPAC Name 3-chloro-5-(trifluoromethyl)pyridine
InChI Key OMRCXTBFBBWTDL-UHFFFAOYSA-N
Molecular Formula C6H3ClF3N
13

4-Iodo-3-methyl-5-phenylisoxazole, 97%, Thermo Scientific™

CAS: 16114-53-7 Molecular Formula: C10H8INO Molecular Weight (g/mol): 285.084 MDL Number: MFCD03086126 InChI Key: RLZGZJOMCXKYIW-UHFFFAOYSA-N Synonym: 4-iodo-3-methyl-5-phenylisoxazole,isoxazole,4-iodo-3-methyl-5-phenyl,3-methyl-5-phenyl-4-iodoisoxazole,4-iodo-3-methylisoxazol-5-yl benzene,4-iodo-3-methyl-1,2-oxazol-5-yl benzene PubChem CID: 2776520 IUPAC Name: 4-iodo-3-methyl-5-phenyl-1,2-oxazole SMILES: CC1=NOC(=C1I)C2=CC=CC=C2

PubChem CID 2776520
CAS 16114-53-7
Molecular Weight (g/mol) 285.084
MDL Number MFCD03086126
SMILES CC1=NOC(=C1I)C2=CC=CC=C2
Synonym 4-iodo-3-methyl-5-phenylisoxazole,isoxazole,4-iodo-3-methyl-5-phenyl,3-methyl-5-phenyl-4-iodoisoxazole,4-iodo-3-methylisoxazol-5-yl benzene,4-iodo-3-methyl-1,2-oxazol-5-yl benzene
IUPAC Name 4-iodo-3-methyl-5-phenyl-1,2-oxazole
InChI Key RLZGZJOMCXKYIW-UHFFFAOYSA-N
Molecular Formula C10H8INO
14

(4-Bromo-1-methyl-1H-pyrazol-3-yl)methanol, ≥97%, Thermo Scientific™

CAS: 915707-65-2 Molecular Formula: C5H7BrN2O Molecular Weight (g/mol): 191.028 MDL Number: MFCD06202888 InChI Key: JFGLJTFTVBZOCB-UHFFFAOYSA-N Synonym: 4-bromo-1-methyl-1h-pyrazol-3-yl methanol,4-bromo-1-methylpyrazol-3-yl methanol,4-bromo-3-hydroxymethyl-1-methyl-1h-pyrazole,4-bromo-1-methylpyrazol-3-yl methan-1-ol,pubchem23717 PubChem CID: 24229713 IUPAC Name: (4-bromo-1-methylpyrazol-3-yl)methanol SMILES: CN1C=C(C(=N1)CO)Br

PubChem CID 24229713
CAS 915707-65-2
Molecular Weight (g/mol) 191.028
MDL Number MFCD06202888
SMILES CN1C=C(C(=N1)CO)Br
Synonym 4-bromo-1-methyl-1h-pyrazol-3-yl methanol,4-bromo-1-methylpyrazol-3-yl methanol,4-bromo-3-hydroxymethyl-1-methyl-1h-pyrazole,4-bromo-1-methylpyrazol-3-yl methan-1-ol,pubchem23717
IUPAC Name (4-bromo-1-methylpyrazol-3-yl)methanol
InChI Key JFGLJTFTVBZOCB-UHFFFAOYSA-N
Molecular Formula C5H7BrN2O
15

2-Bromothiophene-3-carbonitrile, 97%, Thermo Scientific™

CAS: 56182-43-5 Molecular Formula: C5H2BrNS Molecular Weight (g/mol): 188.042 MDL Number: MFCD09064981 InChI Key: GHMDOVNPFWGFSZ-UHFFFAOYSA-N Synonym: 2-bromo-3-cyanothiophene,2-bromo-3-cyanothiophen,2-bromo-3-thiophenecarbonitrile,2-bromo-thiophene-3-carbonitrile,3-thiophenecarbonitrile,2-bromo,2-bromanylthiophene-3-carbonitrile,3-thiophenecarbonitrile, 2-bromo PubChem CID: 12079026 IUPAC Name: 2-bromothiophene-3-carbonitrile SMILES: C1=CSC(=C1C#N)Br

PubChem CID 12079026
CAS 56182-43-5
Molecular Weight (g/mol) 188.042
MDL Number MFCD09064981
SMILES C1=CSC(=C1C#N)Br
Synonym 2-bromo-3-cyanothiophene,2-bromo-3-cyanothiophen,2-bromo-3-thiophenecarbonitrile,2-bromo-thiophene-3-carbonitrile,3-thiophenecarbonitrile,2-bromo,2-bromanylthiophene-3-carbonitrile,3-thiophenecarbonitrile, 2-bromo
IUPAC Name 2-bromothiophene-3-carbonitrile
InChI Key GHMDOVNPFWGFSZ-UHFFFAOYSA-N
Molecular Formula C5H2BrNS