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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O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride, 98%

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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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

2-Fluoro-5-methylbenzonitrile, 99%

CAS: 64113-84-4 Molecular Formula: C8H6FN Molecular Weight (g/mol): 135.141 MDL Number: MFCD00134542 InChI Key: CMAOLVNGLTWICC-UHFFFAOYSA-N Synonym: 6-fluoro-m-tolunitrile,benzonitrile, 2-fluoro-5-methyl,2-fluoro-5-methyl-benzonitrile,3-cyano-4-fluorotoluene,2-fluoro-5-methylbenzenecarbonitrile,pubchem1552,acmc-209nk8,ksc352m4h,2-fluoro-5 methyl benzonitrile,2-fluoro-5-methyl benzonitrile PubChem CID: 2774584 IUPAC Name: 2-fluoro-5-methylbenzonitrile SMILES: CC1=CC(=C(C=C1)F)C#N

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PubChem CID	2774584
CAS	64113-84-4
Molecular Weight (g/mol)	135.141
MDL Number	MFCD00134542
SMILES	CC1=CC(=C(C=C1)F)C#N
Synonym	6-fluoro-m-tolunitrile,benzonitrile, 2-fluoro-5-methyl,2-fluoro-5-methyl-benzonitrile,3-cyano-4-fluorotoluene,2-fluoro-5-methylbenzenecarbonitrile,pubchem1552,acmc-209nk8,ksc352m4h,2-fluoro-5 methyl benzonitrile,2-fluoro-5-methyl benzonitrile
IUPAC Name	2-fluoro-5-methylbenzonitrile
InChI Key	CMAOLVNGLTWICC-UHFFFAOYSA-N
Molecular Formula	C8H6FN

3-Bromo-5-fluorotoluene, 98%

CAS: 202865-83-6 Molecular Formula: C7H6BrF Molecular Weight (g/mol): 189.027 MDL Number: MFCD01861195 InChI Key: CTNFNUQREIIROB-UHFFFAOYSA-N Synonym: 3-bromo-5-fluorotoluene,3-fluoro-5-bromotoluene,5-bromo-3-fluorotoluene,benzene, 1-bromo-3-fluoro-5-methyl,1-bromo-3-fluoro-5-methyl-benzene,3-bromo-5-fluoro toluene,pubchem3237,acmc-1cod9,ksc493k3l,tpc-i111 PubChem CID: 2773396 IUPAC Name: 1-bromo-3-fluoro-5-methylbenzene SMILES: CC1=CC(=CC(=C1)Br)F

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Specifications

PubChem CID	2773396
CAS	202865-83-6
Molecular Weight (g/mol)	189.027
MDL Number	MFCD01861195
SMILES	CC1=CC(=CC(=C1)Br)F
Synonym	3-bromo-5-fluorotoluene,3-fluoro-5-bromotoluene,5-bromo-3-fluorotoluene,benzene, 1-bromo-3-fluoro-5-methyl,1-bromo-3-fluoro-5-methyl-benzene,3-bromo-5-fluoro toluene,pubchem3237,acmc-1cod9,ksc493k3l,tpc-i111
IUPAC Name	1-bromo-3-fluoro-5-methylbenzene
InChI Key	CTNFNUQREIIROB-UHFFFAOYSA-N
Molecular Formula	C7H6BrF

2-Chloro-4-fluorophenylacetic acid, 97%

CAS: 177985-32-9 Molecular Formula: C8H6ClFO2 Molecular Weight (g/mol): 188.582 MDL Number: MFCD00236028 InChI Key: CDUSPKFHAVQVRQ-UHFFFAOYSA-N PubChem CID: 2725061 IUPAC Name: 2-(2-chloro-4-fluorophenyl)acetic acid SMILES: C1=CC(=C(C=C1F)Cl)CC(=O)O

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Specifications

PubChem CID	2725061
CAS	177985-32-9
Molecular Weight (g/mol)	188.582
MDL Number	MFCD00236028
SMILES	C1=CC(=C(C=C1F)Cl)CC(=O)O
IUPAC Name	2-(2-chloro-4-fluorophenyl)acetic acid
InChI Key	CDUSPKFHAVQVRQ-UHFFFAOYSA-N
Molecular Formula	C8H6ClFO2

Methyl 4-bromo-2-fluorophenylacetate, 96%

CAS: 193290-19-6 Molecular Formula: C9H8BrFO2 Molecular Weight (g/mol): 247.06 MDL Number: MFCD20483545 InChI Key: QBGQCRUYARHQGO-UHFFFAOYSA-N Synonym: methyl 2-4-bromo-2-fluorophenyl acetate,methyl 4-bromo-2-fluorophenylacetate,methyl 4-bromo-2-fluorophenyl acetate,methyl 2-4-bromo-2-fluoro-phenyl acetate,4-bromo-2-fluorophenyl acetic acid methyl ester,4-bromo-2-fluoro-phenyl-acetic acid methyl ester,benzeneacetic acid, 4-bromo-2-fluoro-, methyl ester PubChem CID: 53429406 IUPAC Name: methyl 2-(4-bromo-2-fluorophenyl)acetate SMILES: COC(=O)CC1=C(F)C=C(Br)C=C1

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PubChem CID	53429406
CAS	193290-19-6
Molecular Weight (g/mol)	247.06
MDL Number	MFCD20483545
SMILES	COC(=O)CC1=C(F)C=C(Br)C=C1
Synonym	methyl 2-4-bromo-2-fluorophenyl acetate,methyl 4-bromo-2-fluorophenylacetate,methyl 4-bromo-2-fluorophenyl acetate,methyl 2-4-bromo-2-fluoro-phenyl acetate,4-bromo-2-fluorophenyl acetic acid methyl ester,4-bromo-2-fluoro-phenyl-acetic acid methyl ester,benzeneacetic acid, 4-bromo-2-fluoro-, methyl ester
IUPAC Name	methyl 2-(4-bromo-2-fluorophenyl)acetate
InChI Key	QBGQCRUYARHQGO-UHFFFAOYSA-N
Molecular Formula	C9H8BrFO2

1-Fluoro-2,4-dimethoxybenzene, 97%

CAS: 17715-70-7 Molecular Formula: C8H9FO2 Molecular Weight (g/mol): 156.156 MDL Number: MFCD00042265 InChI Key: QLJNEPOEZGFNEA-UHFFFAOYSA-N PubChem CID: 2758413 IUPAC Name: 1-fluoro-2,4-dimethoxybenzene SMILES: COC1=CC(=C(C=C1)F)OC

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PubChem CID	2758413
CAS	17715-70-7
Molecular Weight (g/mol)	156.156
MDL Number	MFCD00042265
SMILES	COC1=CC(=C(C=C1)F)OC
IUPAC Name	1-fluoro-2,4-dimethoxybenzene
InChI Key	QLJNEPOEZGFNEA-UHFFFAOYSA-N
Molecular Formula	C8H9FO2

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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Specifications

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

1,2-Dibromo-5-chloro-3-fluorobenzene, 98%

CAS: 208186-78-1 Molecular Formula: C6H2Br2ClF Molecular Weight (g/mol): 288.34 MDL Number: MFCD00143441 InChI Key: XLDRDGJJGGYJCO-UHFFFAOYSA-N Synonym: 5-chloro-2,3-dibromo-1-fluorobenzene,1-chloro-3,4-dibromo-5-fluorobenzene,5-chloro-2,3-dibromofluorobenzene,5-chloro-1,2-dibromo-3-fluorobenzene,1,2-dibromo-5-chloro-3-fluoro-benzene,acmc-1cpco,benzene,1,2-dibromo-5-chloro-3-fluoro,3,4-dibromo-5-fluorochlorobenzene,3-fluoro-5-chloro-1,2-phenylene dibromide,1,2-bis bromanyl-5-chloranyl-3-fluoranyl-benzene PubChem CID: 2724907 IUPAC Name: 1,2-dibromo-5-chloro-3-fluorobenzene SMILES: FC1=CC(Cl)=CC(Br)=C1Br

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Specifications

PubChem CID	2724907
CAS	208186-78-1
Molecular Weight (g/mol)	288.34
MDL Number	MFCD00143441
SMILES	FC1=CC(Cl)=CC(Br)=C1Br
Synonym	5-chloro-2,3-dibromo-1-fluorobenzene,1-chloro-3,4-dibromo-5-fluorobenzene,5-chloro-2,3-dibromofluorobenzene,5-chloro-1,2-dibromo-3-fluorobenzene,1,2-dibromo-5-chloro-3-fluoro-benzene,acmc-1cpco,benzene,1,2-dibromo-5-chloro-3-fluoro,3,4-dibromo-5-fluorochlorobenzene,3-fluoro-5-chloro-1,2-phenylene dibromide,1,2-bis bromanyl-5-chloranyl-3-fluoranyl-benzene
IUPAC Name	1,2-dibromo-5-chloro-3-fluorobenzene
InChI Key	XLDRDGJJGGYJCO-UHFFFAOYSA-N
Molecular Formula	C6H2Br2ClF

4-Bromo-2-chloro-1-fluorobenzene, 98+%

CAS: 60811-21-4 Molecular Formula: C6H3BrClF Molecular Weight (g/mol): 209.44 MDL Number: MFCD00051794 InChI Key: CJTIWGBQCVYTQE-UHFFFAOYSA-N Synonym: 1-bromo-3-chloro-4-fluorobenzene,3-chloro-4-fluorobromobenzene,4-bromo-2-chlorofluorobenzene,3-chloro-4-fluorobenzene bromide,4-bromo-2-chloro-fluorobenzene,4-bromo-2-chloro-1-fluoro-benzene,benzene, 4-bromo-2-chloro-1-fluoro,pubchem2169,acmc-209mma,ksc493o4n PubChem CID: 3543065 IUPAC Name: 4-bromo-2-chloro-1-fluorobenzene SMILES: FC1=C(Cl)C=C(Br)C=C1

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Specifications

PubChem CID	3543065
CAS	60811-21-4
Molecular Weight (g/mol)	209.44
MDL Number	MFCD00051794
SMILES	FC1=C(Cl)C=C(Br)C=C1
Synonym	1-bromo-3-chloro-4-fluorobenzene,3-chloro-4-fluorobromobenzene,4-bromo-2-chlorofluorobenzene,3-chloro-4-fluorobenzene bromide,4-bromo-2-chloro-fluorobenzene,4-bromo-2-chloro-1-fluoro-benzene,benzene, 4-bromo-2-chloro-1-fluoro,pubchem2169,acmc-209mma,ksc493o4n
IUPAC Name	4-bromo-2-chloro-1-fluorobenzene
InChI Key	CJTIWGBQCVYTQE-UHFFFAOYSA-N
Molecular Formula	C6H3BrClF

2,3,4,5,6-Pentafluorophenylacetic acid, 98+%

CAS: 653-21-4 Molecular Formula: C8H3F5O2 Molecular Weight (g/mol): 226.102 MDL Number: MFCD00004316 InChI Key: LGCODSNZJOVMHV-UHFFFAOYSA-N Synonym: pentafluorophenylacetic acid,2,3,4,5,6-pentafluorophenylacetic acid,pentafluorophenyl acetic acid,2-perfluorophenyl acetic acid,2-2,3,4,5,6-pentafluorophenyl acetic acid,2,3,4,5,6-pentafluorphenylacetic acid,benzeneacetic acid, 2,3,4,5,6-pentafluoro,acmc-20aoj2,pentafluorophenylaceticacid,2-pentafluorophenyl acetic acid PubChem CID: 69553 IUPAC Name: 2-(2,3,4,5,6-pentafluorophenyl)acetic acid SMILES: C(C1=C(C(=C(C(=C1F)F)F)F)F)C(=O)O

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Specifications

PubChem CID	69553
CAS	653-21-4
Molecular Weight (g/mol)	226.102
MDL Number	MFCD00004316
SMILES	C(C1=C(C(=C(C(=C1F)F)F)F)F)C(=O)O
Synonym	pentafluorophenylacetic acid,2,3,4,5,6-pentafluorophenylacetic acid,pentafluorophenyl acetic acid,2-perfluorophenyl acetic acid,2-2,3,4,5,6-pentafluorophenyl acetic acid,2,3,4,5,6-pentafluorphenylacetic acid,benzeneacetic acid, 2,3,4,5,6-pentafluoro,acmc-20aoj2,pentafluorophenylaceticacid,2-pentafluorophenyl acetic acid
IUPAC Name	2-(2,3,4,5,6-pentafluorophenyl)acetic acid
InChI Key	LGCODSNZJOVMHV-UHFFFAOYSA-N
Molecular Formula	C8H3F5O2

3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carboxylic acid, 99%

CAS: 3919-74-2 Molecular Formula: C11H7ClFNO3 Molecular Weight (g/mol): 255.63 MDL Number: MFCD00055659 InChI Key: REIPZLFZMOQHJT-UHFFFAOYSA-N Synonym: 3-2-chloro-6-fluorophenyl-5-methylisoxazole-4-carboxylic acid,3-2-chloro-6-fluorophenyl-5-methyl-1,2-oxazole-4-carboxylic acid,fcimic acid,4-isoxazolecarboxylic acid, 3-2-chloro-6-fluorophenyl-5-methyl,3-2-chloro-6-fluorophenyl-5-methyl-4-isoxazolecarboxylic acid,3-2-dihloro-6-fluorophenyl-5-methylisoxazole-4-carboxylic acid,3-2-chloro-6-fluorophenyl-5-methyl-4-isoxazolecarboxic acid,pubchem8772,acmc-1ckjh,3-2-chloro-6-fluorophenyl 5-methylisoxazole-4-carboxylic acid PubChem CID: 77520 IUPAC Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxylic acid SMILES: CC1=C(C(O)=O)C(=NO1)C1=C(F)C=CC=C1Cl

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Specifications

PubChem CID	77520
CAS	3919-74-2
Molecular Weight (g/mol)	255.63
MDL Number	MFCD00055659
SMILES	CC1=C(C(O)=O)C(=NO1)C1=C(F)C=CC=C1Cl
Synonym	3-2-chloro-6-fluorophenyl-5-methylisoxazole-4-carboxylic acid,3-2-chloro-6-fluorophenyl-5-methyl-1,2-oxazole-4-carboxylic acid,fcimic acid,4-isoxazolecarboxylic acid, 3-2-chloro-6-fluorophenyl-5-methyl,3-2-chloro-6-fluorophenyl-5-methyl-4-isoxazolecarboxylic acid,3-2-dihloro-6-fluorophenyl-5-methylisoxazole-4-carboxylic acid,3-2-chloro-6-fluorophenyl-5-methyl-4-isoxazolecarboxic acid,pubchem8772,acmc-1ckjh,3-2-chloro-6-fluorophenyl 5-methylisoxazole-4-carboxylic acid
IUPAC Name	3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxylic acid
InChI Key	REIPZLFZMOQHJT-UHFFFAOYSA-N
Molecular Formula	C11H7ClFNO3

2,4-Difluoroaniline, 99%

CAS: 367-25-9 Molecular Formula: C6H5F2N Molecular Weight (g/mol): 129.11 MDL Number: MFCD00007648 InChI Key: CEPCPXLLFXPZGW-UHFFFAOYSA-N Synonym: 2,4-difluorobenzenamine,benzenamine, 2,4-difluoro,2,4-difluroaniline,2,4-difluorophenylamine,aniline, 2,4-difluoro,unii-40p93l7kwd,1-amino-2,4-difluorobenzene,ccris 4621,2,4-difluoro aniline,2,4-difluoro-phenylamine PubChem CID: 9709 IUPAC Name: 2,4-difluoroaniline SMILES: NC1=CC=C(F)C=C1F

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Specifications

PubChem CID	9709
CAS	367-25-9
Molecular Weight (g/mol)	129.11
MDL Number	MFCD00007648
SMILES	NC1=CC=C(F)C=C1F
Synonym	2,4-difluorobenzenamine,benzenamine, 2,4-difluoro,2,4-difluroaniline,2,4-difluorophenylamine,aniline, 2,4-difluoro,unii-40p93l7kwd,1-amino-2,4-difluorobenzene,ccris 4621,2,4-difluoro aniline,2,4-difluoro-phenylamine
IUPAC Name	2,4-difluoroaniline
InChI Key	CEPCPXLLFXPZGW-UHFFFAOYSA-N
Molecular Formula	C6H5F2N

Phenylethyl isothiocyanate, 96%

CAS: 2257-09-2 Molecular Formula: C₉H₉NS Molecular Weight (g/mol): 163.24 MDL Number: MFCD00004821 InChI Key: IZJDOKYDEWTZSO-UHFFFAOYSA-N ChEBI: CHEBI:351346

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Specifications

CAS	2257-09-2
Molecular Weight (g/mol)	163.24
ChEBI	CHEBI:351346
MDL Number	MFCD00004821
InChI Key	IZJDOKYDEWTZSO-UHFFFAOYSA-N
Molecular Formula	C₉H₉NS

(R)-(-)-4-Fluorostyrene oxide, 98+%, ee 98+%, Thermo Scientific Chemicals

CAS: 134356-73-3 Molecular Formula: C8H7FO Molecular Weight (g/mol): 138.14 MDL Number: MFCD03788740,MFCD00043994,MFCD03788740 InChI Key: ICVNPQMUUHPPOK-UHFFFAOYNA-N Synonym: r-4-fluorophenyl oxirane,r-2-4-fluorophenyl oxirane,2r-2-4-fluorophenyl oxirane,r-4-fluorostyrene oxide,r---4-fluorostyrene oxide,pubchem18166,r-4-fluorophenyl oxirane, technical gc PubChem CID: 7023123 IUPAC Name: (2R)-2-(4-fluorophenyl)oxirane SMILES: FC1=CC=C(C=C1)C1CO1

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Specifications

PubChem CID	7023123
CAS	134356-73-3
Molecular Weight (g/mol)	138.14
MDL Number	MFCD03788740,MFCD00043994,MFCD03788740
SMILES	FC1=CC=C(C=C1)C1CO1
Synonym	r-4-fluorophenyl oxirane,r-2-4-fluorophenyl oxirane,2r-2-4-fluorophenyl oxirane,r-4-fluorostyrene oxide,r---4-fluorostyrene oxide,pubchem18166,r-4-fluorophenyl oxirane, technical gc
IUPAC Name	(2R)-2-(4-fluorophenyl)oxirane
InChI Key	ICVNPQMUUHPPOK-UHFFFAOYNA-N
Molecular Formula	C8H7FO

6-Bromo-2,3-difluorotoluene, 95%

CAS: 847502-81-2 Molecular Formula: C7H5BrF2 Molecular Weight (g/mol): 207.018 MDL Number: MFCD07777161 InChI Key: YXTCBTSPHSNDHD-UHFFFAOYSA-N PubChem CID: 12137677 IUPAC Name: 1-bromo-3,4-difluoro-2-methylbenzene SMILES: CC1=C(C=CC(=C1F)F)Br

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Specifications

PubChem CID	12137677
CAS	847502-81-2
Molecular Weight (g/mol)	207.018
MDL Number	MFCD07777161
SMILES	CC1=C(C=CC(=C1F)F)Br
IUPAC Name	1-bromo-3,4-difluoro-2-methylbenzene
InChI Key	YXTCBTSPHSNDHD-UHFFFAOYSA-N
Molecular Formula	C7H5BrF2

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