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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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

O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride, 99+%

CAS: 57981-02-9 Molecular Formula: C7H5ClF5NO Molecular Weight (g/mol): 249.57 MDL Number: MFCD00012953 InChI Key: HVMVKNXIMUCYJA-UHFFFAOYSA-N Synonym: o-2,3,4,5,6-pentafluorobenzyl hydroxylamine hydrochloride,florox reagent,o-perfluorophenyl methyl hydroxylamine hydrochloride,hydroxylamine, o-pentafluorophenyl methyl-, hydrochloride,o-pentafluorobenzyl hydroxylamine hydrochloride,o-2,3,4,5,6-pentafluorophenyl methyl hydroxylamine hydrochloride,oxy 2,3,4,5,6-pentafluorophenyl methyl amine, chloride,pfbha.hcl,acmc-1b0zv PubChem CID: 122307 IUPAC Name: O-[(2,3,4,5,6-pentafluorophenyl)methyl]hydroxylamine;hydrochloride SMILES: [H+].[Cl-].NOCC1=C(F)C(F)=C(F)C(F)=C1F

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Specifications

PubChem CID	122307
CAS	57981-02-9
Molecular Weight (g/mol)	249.57
MDL Number	MFCD00012953
SMILES	[H+].[Cl-].NOCC1=C(F)C(F)=C(F)C(F)=C1F
Synonym	o-2,3,4,5,6-pentafluorobenzyl hydroxylamine hydrochloride,florox reagent,o-perfluorophenyl methyl hydroxylamine hydrochloride,hydroxylamine, o-pentafluorophenyl methyl-, hydrochloride,o-pentafluorobenzyl hydroxylamine hydrochloride,o-2,3,4,5,6-pentafluorophenyl methyl hydroxylamine hydrochloride,oxy 2,3,4,5,6-pentafluorophenyl methyl amine, chloride,pfbha.hcl,acmc-1b0zv
IUPAC Name	O-[(2,3,4,5,6-pentafluorophenyl)methyl]hydroxylamine;hydrochloride
InChI Key	HVMVKNXIMUCYJA-UHFFFAOYSA-N
Molecular Formula	C7H5ClF5NO

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

4-Fluorobenzonitrile, 99%

CAS: 1194-02-1 Molecular Formula: C₇H₄FN Molecular Weight (g/mol): 121.11 MDL Number: MFCD00001812 InChI Key: AEKVBBNGWBBYLL-UHFFFAOYSA-N Synonym: p-fluorobenzonitrile,benzonitrile, 4-fluoro,4-cyanofluorobenzene,p-cyanofluorobenzene,benzonitrile, p-fluoro,4-fluoro-benzonitrile,4-fluorobenzenecarbonitrile,4-fluorobenzonitril,pfbn,1-cyano-4-fluorobenzene PubChem CID: 14517 IUPAC Name: 4-fluorobenzonitrile SMILES: C1=CC(=CC=C1C#N)F

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Specifications

PubChem CID	14517
CAS	1194-02-1
Molecular Weight (g/mol)	121.11
MDL Number	MFCD00001812
SMILES	C1=CC(=CC=C1C#N)F
Synonym	p-fluorobenzonitrile,benzonitrile, 4-fluoro,4-cyanofluorobenzene,p-cyanofluorobenzene,benzonitrile, p-fluoro,4-fluoro-benzonitrile,4-fluorobenzenecarbonitrile,4-fluorobenzonitril,pfbn,1-cyano-4-fluorobenzene
IUPAC Name	4-fluorobenzonitrile
InChI Key	AEKVBBNGWBBYLL-UHFFFAOYSA-N
Molecular Formula	C₇H₄FN

1-Bromo-4-fluorobenzene, 99%

CAS: 460-00-4 Molecular Formula: C6H4BrF Molecular Weight (g/mol): 175.00 MDL Number: MFCD00000342 InChI Key: AITNMTXHTIIIBB-UHFFFAOYSA-N Synonym: 4-bromofluorobenzene,p-bromofluorobenzene,p-fluorobromobenzene,4-fluorobromobenzene,benzene, 1-bromo-4-fluoro,4-fluorophenyl bromide,1-fluoro-4-bromobenzene,4-fluoro-1-bromobenzene,p-fluorophenyl bromide,bromo fluorobenzene PubChem CID: 9993 IUPAC Name: 1-bromo-4-fluorobenzene SMILES: FC1=CC=C(Br)C=C1

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Specifications

PubChem CID	9993
CAS	460-00-4
Molecular Weight (g/mol)	175.00
MDL Number	MFCD00000342
SMILES	FC1=CC=C(Br)C=C1
Synonym	4-bromofluorobenzene,p-bromofluorobenzene,p-fluorobromobenzene,4-fluorobromobenzene,benzene, 1-bromo-4-fluoro,4-fluorophenyl bromide,1-fluoro-4-bromobenzene,4-fluoro-1-bromobenzene,p-fluorophenyl bromide,bromo fluorobenzene
IUPAC Name	1-bromo-4-fluorobenzene
InChI Key	AITNMTXHTIIIBB-UHFFFAOYSA-N
Molecular Formula	C6H4BrF

Pentafluorobenzonitrile, 98%

CAS: 773-82-0 Molecular Formula: C7F5N Molecular Weight (g/mol): 193.076 MDL Number: MFCD00001775 InChI Key: YXWJGZQOGXGSSC-UHFFFAOYSA-N Synonym: pentafluorobenzonitrile,perfluorobenzonitrile,benzonitrile, pentafluoro,pentafluorocyanobenzene,benzonitrile, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluoro benzonitrile,2,3,4,5,6-pentafluorobenzenecarbonitrile,cyanopentafluorobenzene,pubchem2319,acmc-209p9k PubChem CID: 69882 IUPAC Name: 2,3,4,5,6-pentafluorobenzonitrile SMILES: C(#N)C1=C(C(=C(C(=C1F)F)F)F)F

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Specifications

PubChem CID	69882
CAS	773-82-0
Molecular Weight (g/mol)	193.076
MDL Number	MFCD00001775
SMILES	C(#N)C1=C(C(=C(C(=C1F)F)F)F)F
Synonym	pentafluorobenzonitrile,perfluorobenzonitrile,benzonitrile, pentafluoro,pentafluorocyanobenzene,benzonitrile, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluoro benzonitrile,2,3,4,5,6-pentafluorobenzenecarbonitrile,cyanopentafluorobenzene,pubchem2319,acmc-209p9k
IUPAC Name	2,3,4,5,6-pentafluorobenzonitrile
InChI Key	YXWJGZQOGXGSSC-UHFFFAOYSA-N
Molecular Formula	C7F5N

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

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