Fluorobenzenes

Organic compounds considered aryl halides that consist of a phenyl group with a fluorine atom substitution in the following structure: C₆H₅F.

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Fluorobenzene, 99%

CAS: 462-06-6 Molecular Formula: C6H5F Molecular Weight (g/mol): 96.10 MDL Number: MFCD00000280 InChI Key: PYLWMHQQBFSUBP-UHFFFAOYSA-N Synonym: benzene, fluoro,monofluorobenzene,phenyl fluoride,fluorbenzol,fluoro-benzene,4-fluorobenzene,unii-g3tsz68k12,fluoranylbenzene,fluorobenzenes,1,2,3,4,5-pentadeuterio-6-fluorobenzene PubChem CID: 10008 ChEBI: CHEBI:5115 IUPAC Name: fluorobenzene SMILES: FC1=CC=CC=C1

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PubChem CID	10008
CAS	462-06-6
Molecular Weight (g/mol)	96.10
ChEBI	CHEBI:5115
MDL Number	MFCD00000280
SMILES	FC1=CC=CC=C1
Synonym	benzene, fluoro,monofluorobenzene,phenyl fluoride,fluorbenzol,fluoro-benzene,4-fluorobenzene,unii-g3tsz68k12,fluoranylbenzene,fluorobenzenes,1,2,3,4,5-pentadeuterio-6-fluorobenzene
IUPAC Name	fluorobenzene
InChI Key	PYLWMHQQBFSUBP-UHFFFAOYSA-N
Molecular Formula	C6H5F

PubChem CID	10008
CAS	462-06-6
Molecular Weight (g/mol)	96.10
ChEBI	CHEBI:5115
MDL Number	MFCD00000280
SMILES	FC1=CC=CC=C1
Synonym	benzene, fluoro,monofluorobenzene,phenyl fluoride,fluorbenzol,fluoro-benzene,4-fluorobenzene,unii-g3tsz68k12,fluoranylbenzene,fluorobenzenes,1,2,3,4,5-pentadeuterio-6-fluorobenzene
IUPAC Name	fluorobenzene
InChI Key	PYLWMHQQBFSUBP-UHFFFAOYSA-N
Molecular Formula	C6H5F

2,4-Difluorophenylacetic acid, 99%

CAS: 81228-09-3 Molecular Formula: C8H5F2O2 Molecular Weight (g/mol): 171.12 MDL Number: MFCD00009999 InChI Key: QPKZIGHNRLZBCL-UHFFFAOYSA-M Synonym: 2,4-difluorophenylacetic acid,2-2,4-difluorophenyl acetic acid,benzeneacetic acid, 2,4-difluoro,2,4-difluorophenyl acetic acid,2,4-ddifluorophenylacetic acid,rarechem al bo 0247,2,4-difluoro-phenyl-acetic acid,2,4-difluorobenzeneacetic acid,2,4-difluorophenylaceticacid PubChem CID: 123581 IUPAC Name: 2-(2,4-difluorophenyl)acetic acid SMILES: [O-]C(=O)CC1=CC=C(F)C=C1F

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PubChem CID	123581
CAS	81228-09-3
Molecular Weight (g/mol)	171.12
MDL Number	MFCD00009999
SMILES	[O-]C(=O)CC1=CC=C(F)C=C1F
Synonym	2,4-difluorophenylacetic acid,2-2,4-difluorophenyl acetic acid,benzeneacetic acid, 2,4-difluoro,2,4-difluorophenyl acetic acid,2,4-ddifluorophenylacetic acid,rarechem al bo 0247,2,4-difluoro-phenyl-acetic acid,2,4-difluorobenzeneacetic acid,2,4-difluorophenylaceticacid
IUPAC Name	2-(2,4-difluorophenyl)acetic acid
InChI Key	QPKZIGHNRLZBCL-UHFFFAOYSA-M
Molecular Formula	C8H5F2O2

1,3-Difluorobenzene, 99+%

CAS: 372-18-9 Molecular Formula: C6H4F2 Molecular Weight (g/mol): 114.10 MDL Number: MFCD00000327 InChI Key: UEMGWPRHOOEKTA-UHFFFAOYSA-N Synonym: m-difluorobenzene,benzene, 1,3-difluoro,benzene, m-difluoro,2,4-difluorobenzene,meta-difluorobenzene,1,3-difluoro benzene,unii-vo3c26woc2,1,3-difluorbenzol,vo3c26woc2,1,3difluorobenzene PubChem CID: 9741 ChEBI: CHEBI:38584 IUPAC Name: 1,3-difluorobenzene SMILES: FC1=CC(F)=CC=C1

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Specifications

PubChem CID	9741
CAS	372-18-9
Molecular Weight (g/mol)	114.10
ChEBI	CHEBI:38584
MDL Number	MFCD00000327
SMILES	FC1=CC(F)=CC=C1
Synonym	m-difluorobenzene,benzene, 1,3-difluoro,benzene, m-difluoro,2,4-difluorobenzene,meta-difluorobenzene,1,3-difluoro benzene,unii-vo3c26woc2,1,3-difluorbenzol,vo3c26woc2,1,3difluorobenzene
IUPAC Name	1,3-difluorobenzene
InChI Key	UEMGWPRHOOEKTA-UHFFFAOYSA-N
Molecular Formula	C6H4F2

4-Fluoroaniline, 99%

CAS: 371-40-4 Molecular Formula: C6H6FN Molecular Weight (g/mol): 111.12 MDL Number: MFCD00007829 InChI Key: KRZCOLNOCZKSDF-UHFFFAOYSA-N Synonym: p-fluoroaniline,benzenamine, 4-fluoro,1-amino-4-fluorobenzene,4-fluorobenzenamine,p-fluorophenylamine,4-fluoronaniline,aniline, p-fluoro,aniline, 4-fluoro,4-fluoranilin,para-fluoroaniline PubChem CID: 9731 ChEBI: CHEBI:28546 IUPAC Name: 4-fluoroaniline SMILES: NC1=CC=C(F)C=C1

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Specifications

PubChem CID	9731
CAS	371-40-4
Molecular Weight (g/mol)	111.12
ChEBI	CHEBI:28546
MDL Number	MFCD00007829
SMILES	NC1=CC=C(F)C=C1
Synonym	p-fluoroaniline,benzenamine, 4-fluoro,1-amino-4-fluorobenzene,4-fluorobenzenamine,p-fluorophenylamine,4-fluoronaniline,aniline, p-fluoro,aniline, 4-fluoro,4-fluoranilin,para-fluoroaniline
IUPAC Name	4-fluoroaniline
InChI Key	KRZCOLNOCZKSDF-UHFFFAOYSA-N
Molecular Formula	C6H6FN

Thermo Scientific Chemicals Fluconazole, 98%

CAS: 86386-73-4 Molecular Formula: C₁₃H₁₂F₂N₆O Molecular Weight (g/mol): 306.27 InChI Key: RFHAOTPXVQNOHP-UHFFFAOYSA-N Synonym: fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol PubChem CID: 3365 ChEBI: CHEBI:46081 IUPAC Name: 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol SMILES: C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O

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Specifications

PubChem CID	3365
CAS	86386-73-4
Molecular Weight (g/mol)	306.27
ChEBI	CHEBI:46081
SMILES	C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O
Synonym	fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol
IUPAC Name	2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol
InChI Key	RFHAOTPXVQNOHP-UHFFFAOYSA-N
Molecular Formula	C₁₃H₁₂F₂N₆O

1,2-Difluorobenzene, 98+%

CAS: 367-11-3 Molecular Formula: C6H4F2 Molecular Weight (g/mol): 114.10 MDL Number: MFCD00000284 InChI Key: GOYDNIKZWGIXJT-UHFFFAOYSA-N Synonym: o-difluorobenzene,benzene, 1,2-difluoro,benzene, o-difluoro,ortho-difluorobenzene,o-difluoro benzene,difluorobenzene,1,2-difluoro-benzene,unii-aw7qgmw29c,aw7qgmw29c,0-difluorobenzene PubChem CID: 9706 ChEBI: CHEBI:38583 IUPAC Name: 1,2-difluorobenzene SMILES: FC1=CC=CC=C1F

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Specifications

PubChem CID	9706
CAS	367-11-3
Molecular Weight (g/mol)	114.10
ChEBI	CHEBI:38583
MDL Number	MFCD00000284
SMILES	FC1=CC=CC=C1F
Synonym	o-difluorobenzene,benzene, 1,2-difluoro,benzene, o-difluoro,ortho-difluorobenzene,o-difluoro benzene,difluorobenzene,1,2-difluoro-benzene,unii-aw7qgmw29c,aw7qgmw29c,0-difluorobenzene
IUPAC Name	1,2-difluorobenzene
InChI Key	GOYDNIKZWGIXJT-UHFFFAOYSA-N
Molecular Formula	C6H4F2

1-Chloro-3-fluorobenzene, 99%

CAS: 625-98-9 Molecular Formula: C6H4ClF Molecular Weight (g/mol): 130.55 MDL Number: MFCD00000569 InChI Key: VZHJIJZEOCBKRA-UHFFFAOYSA-N Synonym: m-chlorofluorobenzene,3-chlorofluorobenzene,benzene, 1-chloro-3-fluoro,m-fluorochlorobenzene,3-fluorochlorobenzene,1-fluoro-3-chlorobenzene,1-chloro-3-fluoro-benzene,m-fluoro chlorobenzene,pubchem3419,3-fluoro-chlorobenzene PubChem CID: 223087 IUPAC Name: 1-chloro-3-fluorobenzene SMILES: FC1=CC=CC(Cl)=C1

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Specifications

PubChem CID	223087
CAS	625-98-9
Molecular Weight (g/mol)	130.55
MDL Number	MFCD00000569
SMILES	FC1=CC=CC(Cl)=C1
Synonym	m-chlorofluorobenzene,3-chlorofluorobenzene,benzene, 1-chloro-3-fluoro,m-fluorochlorobenzene,3-fluorochlorobenzene,1-fluoro-3-chlorobenzene,1-chloro-3-fluoro-benzene,m-fluoro chlorobenzene,pubchem3419,3-fluoro-chlorobenzene
IUPAC Name	1-chloro-3-fluorobenzene
InChI Key	VZHJIJZEOCBKRA-UHFFFAOYSA-N
Molecular Formula	C6H4ClF

Pentafluoroaniline, 97%

CAS: 771-60-8 Molecular Formula: C6H2F5N Molecular Weight (g/mol): 183.08 MDL Number: MFCD00007643 InChI Key: NOXLGCOSAFGMDV-UHFFFAOYSA-N Synonym: pentafluoroaniline,pentafluorophenylamine,aminopentafluorobenzene,benzenamine, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluorobenzenamine,aniline, 2,3,4,5,6-pentafluoro,unii-ms06il3y2q,ms06il3y2q,2,3,4,5,6-pentafluorophenylamine,pubchem1546 PubChem CID: 13040 SMILES: NC1=C(F)C(F)=C(F)C(F)=C1F

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Specifications

PubChem CID	13040
CAS	771-60-8
Molecular Weight (g/mol)	183.08
MDL Number	MFCD00007643
SMILES	NC1=C(F)C(F)=C(F)C(F)=C1F
Synonym	pentafluoroaniline,pentafluorophenylamine,aminopentafluorobenzene,benzenamine, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluorobenzenamine,aniline, 2,3,4,5,6-pentafluoro,unii-ms06il3y2q,ms06il3y2q,2,3,4,5,6-pentafluorophenylamine,pubchem1546
InChI Key	NOXLGCOSAFGMDV-UHFFFAOYSA-N
Molecular Formula	C6H2F5N

Thermo Scientific Chemicals Fluconazole, 98%

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Potassium 2,4-difluorophenyltrifluoroborate, 95%

CAS: 871231-41-3 Molecular Formula: C6H3BF5K Molecular Weight (g/mol): 219.99 MDL Number: MFCD07784375 InChI Key: HZKKNPYRMYVEOW-UHFFFAOYSA-N Synonym: potassium 2,4-difluorophenyltrifluoroborate,potassium 2,4-difluorophenyl trifluoroborate,potassium 2,4-difluorophenyl trifluoroboranuide,pubchem11329,potassium 2,4-difluorophenyl trifluoro borate 1- PubChem CID: 23697340 IUPAC Name: potassium;(2,4-difluorophenyl)-trifluoroboranuide SMILES: [B-](C1=C(C=C(C=C1)F)F)(F)(F)F.[K+]

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Specifications

PubChem CID	23697340
CAS	871231-41-3
Molecular Weight (g/mol)	219.99
MDL Number	MFCD07784375
SMILES	[B-](C1=C(C=C(C=C1)F)F)(F)(F)F.[K+]
Synonym	potassium 2,4-difluorophenyltrifluoroborate,potassium 2,4-difluorophenyl trifluoroborate,potassium 2,4-difluorophenyl trifluoroboranuide,pubchem11329,potassium 2,4-difluorophenyl trifluoro borate 1-
IUPAC Name	potassium;(2,4-difluorophenyl)-trifluoroboranuide
InChI Key	HZKKNPYRMYVEOW-UHFFFAOYSA-N
Molecular Formula	C6H3BF5K

3-Chloro-5-fluorobenzeneboronic acid, 95%

CAS: 328956-61-2 Molecular Formula: C6H5BClFO2 Molecular Weight (g/mol): 174.36 MDL Number: MFCD06801741 InChI Key: XYQDHVBKUNNLGZ-UHFFFAOYSA-N Synonym: 3-chloro-5-fluorobenzeneboronic acid,3-chloro-5-fluorophenyl boronic acid,boronic acid, 3-chloro-5-fluorophenyl,pubchem6363,acmc-1agjy,ksc497k5n,3-borono-5-fluorochlorobenzene,3-chloro-5-fluoro-benzeneboronic acid,3-chloro-5-fluoro-phenyl boronic acid,3-chloranyl-5-fluoranyl-phenyl boronic acid PubChem CID: 15391287 IUPAC Name: (3-chloro-5-fluorophenyl)boronic acid SMILES: OB(O)C1=CC(F)=CC(Cl)=C1

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Specifications

PubChem CID	15391287
CAS	328956-61-2
Molecular Weight (g/mol)	174.36
MDL Number	MFCD06801741
SMILES	OB(O)C1=CC(F)=CC(Cl)=C1
Synonym	3-chloro-5-fluorobenzeneboronic acid,3-chloro-5-fluorophenyl boronic acid,boronic acid, 3-chloro-5-fluorophenyl,pubchem6363,acmc-1agjy,ksc497k5n,3-borono-5-fluorochlorobenzene,3-chloro-5-fluoro-benzeneboronic acid,3-chloro-5-fluoro-phenyl boronic acid,3-chloranyl-5-fluoranyl-phenyl boronic acid
IUPAC Name	(3-chloro-5-fluorophenyl)boronic acid
InChI Key	XYQDHVBKUNNLGZ-UHFFFAOYSA-N
Molecular Formula	C6H5BClFO2

2-Bromofluorobenzene, 99%

CAS: 1072-85-1 Molecular Formula: C₆H₄BrF Molecular Weight (g/mol): 175 MDL Number: MFCD00000282 InChI Key: IPWBFGUBXWMIPR-UHFFFAOYSA-N Synonym: 2-bromofluorobenzene,o-bromofluorobenzene,2-fluorobromobenzene,o-fluorobromobenzene,2-bromfluorbenzen,benzene, 1-bromo-2-fluoro,1-fluoro-2-bromobenzene,benzene, 1-fluoro-2-bromo,ofbb,benzene, bromofluoro PubChem CID: 61259 IUPAC Name: 1-bromo-2-fluorobenzene SMILES: C1=CC=C(C(=C1)F)Br

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Specifications

PubChem CID	61259
CAS	1072-85-1
Molecular Weight (g/mol)	175
MDL Number	MFCD00000282
SMILES	C1=CC=C(C(=C1)F)Br
Synonym	2-bromofluorobenzene,o-bromofluorobenzene,2-fluorobromobenzene,o-fluorobromobenzene,2-bromfluorbenzen,benzene, 1-bromo-2-fluoro,1-fluoro-2-bromobenzene,benzene, 1-fluoro-2-bromo,ofbb,benzene, bromofluoro
IUPAC Name	1-bromo-2-fluorobenzene
InChI Key	IPWBFGUBXWMIPR-UHFFFAOYSA-N
Molecular Formula	C₆H₄BrF

5-Chloro-2-fluorobenzeneboronic acid, 97%

CAS: 352535-83-2 Molecular Formula: C6H5BClFO2 Molecular Weight (g/mol): 174.36 MDL Number: MFCD05664225 InChI Key: GGTUVWGMCFXUAS-UHFFFAOYSA-N Synonym: 5-chloro-2-fluorophenyl boronic acid,5-chloro-2-fluorobenzeneboronic acid,5-chloro-2-fluorophenylboronicacid,5-chloro-2-fluoro-phenyl boronic acid,boronic acid, 5-chloro-2-fluorophenyl,pubchem11819,acmc-1ae0a,boronic acid,b-5-chloro-2-fluorophenyl,boronic acid, b-5-chloro-2-fluorophenyl PubChem CID: 3718925 IUPAC Name: (5-chloro-2-fluorophenyl)boronic acid SMILES: OB(O)C1=CC(Cl)=CC=C1F

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Specifications

PubChem CID	3718925
CAS	352535-83-2
Molecular Weight (g/mol)	174.36
MDL Number	MFCD05664225
SMILES	OB(O)C1=CC(Cl)=CC=C1F
Synonym	5-chloro-2-fluorophenyl boronic acid,5-chloro-2-fluorobenzeneboronic acid,5-chloro-2-fluorophenylboronicacid,5-chloro-2-fluoro-phenyl boronic acid,boronic acid, 5-chloro-2-fluorophenyl,pubchem11819,acmc-1ae0a,boronic acid,b-5-chloro-2-fluorophenyl,boronic acid, b-5-chloro-2-fluorophenyl
IUPAC Name	(5-chloro-2-fluorophenyl)boronic acid
InChI Key	GGTUVWGMCFXUAS-UHFFFAOYSA-N
Molecular Formula	C6H5BClFO2

1,3,5-Tris(chloromethyl)-2,4,6-trimethylbenzene, 97%

CAS: 3849-01-2 Molecular Formula: C12H15Cl3 Molecular Weight (g/mol): 265.60 MDL Number: MFCD00229016 InChI Key: PHQFMPNZCIHSPC-UHFFFAOYSA-N IUPAC Name: 1,3,5-tris(chloromethyl)-2,4,6-trimethylbenzene

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Specifications

CAS	3849-01-2
Molecular Weight (g/mol)	265.60
MDL Number	MFCD00229016
IUPAC Name	1,3,5-tris(chloromethyl)-2,4,6-trimethylbenzene
InChI Key	PHQFMPNZCIHSPC-UHFFFAOYSA-N
Molecular Formula	C12H15Cl3

Fluorobenzenes

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