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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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1

(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

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
2

Methyl 2-fluorophenylacetate, 99%, Thermo Scientific™

CAS: 57486-67-6 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.17 MDL Number: MFCD00800605 InChI Key: TWXVEZBPKFIMBB-UHFFFAOYSA-N Synonym: methyl 2-2-fluorophenyl acetate,methyl 2-fluorophenyl acetate,methyl 2-fluorophenylacetate,2-fluorophenylacetic acid methyl ester,benzeneacetic acid, 2-fluoro-, methyl ester,2-fluoro-phenyl-acetic acid methyl ester,methyl 2-2-fluorophenyl ethanoate,2-fluoro-phenylacetic acid methyl ester,2-2-fluorophenyl acetic acid methyl ester PubChem CID: 2733230 IUPAC Name: methyl 2-(2-fluorophenyl)acetate SMILES: COC(=O)CC1=CC=CC=C1F

PubChem CID 2733230
CAS 57486-67-6
Molecular Weight (g/mol) 168.17
MDL Number MFCD00800605
SMILES COC(=O)CC1=CC=CC=C1F
Synonym methyl 2-2-fluorophenyl acetate,methyl 2-fluorophenyl acetate,methyl 2-fluorophenylacetate,2-fluorophenylacetic acid methyl ester,benzeneacetic acid, 2-fluoro-, methyl ester,2-fluoro-phenyl-acetic acid methyl ester,methyl 2-2-fluorophenyl ethanoate,2-fluoro-phenylacetic acid methyl ester,2-2-fluorophenyl acetic acid methyl ester
IUPAC Name methyl 2-(2-fluorophenyl)acetate
InChI Key TWXVEZBPKFIMBB-UHFFFAOYSA-N
Molecular Formula C9H9FO2
3

Methyl 3-fluorophenylacetate, 98%

CAS: 64123-77-9 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.17 MDL Number: MFCD03093288 InChI Key: OXYLCGRXCQARQV-UHFFFAOYSA-N Synonym: methyl 2-3-fluorophenyl acetate,methyl 3-fluorophenylacetate,methyl3-fluorophenylacetate,methyl 3-fluorophenyl acetate,3-fluorobenzeneacetic acid methyl ester,benzeneacetic acid, 3-fluoro-, methyl ester,3-fluorophenylacetic acid methyl ester,3-fluorophenyl acetic acid methyl ester,3-fluoro-phenyl-acetic acid methyl ester,2-3-fluorophenyl acetic acid methyl ester PubChem CID: 2734108 IUPAC Name: methyl 2-(3-fluorophenyl)acetate SMILES: COC(=O)CC1=CC=CC(F)=C1

PubChem CID 2734108
CAS 64123-77-9
Molecular Weight (g/mol) 168.17
MDL Number MFCD03093288
SMILES COC(=O)CC1=CC=CC(F)=C1
Synonym methyl 2-3-fluorophenyl acetate,methyl 3-fluorophenylacetate,methyl3-fluorophenylacetate,methyl 3-fluorophenyl acetate,3-fluorobenzeneacetic acid methyl ester,benzeneacetic acid, 3-fluoro-, methyl ester,3-fluorophenylacetic acid methyl ester,3-fluorophenyl acetic acid methyl ester,3-fluoro-phenyl-acetic acid methyl ester,2-3-fluorophenyl acetic acid methyl ester
IUPAC Name methyl 2-(3-fluorophenyl)acetate
InChI Key OXYLCGRXCQARQV-UHFFFAOYSA-N
Molecular Formula C9H9FO2
4

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

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
5

Pentafluorobenzonitrile, 99%

CAS: 773-82-0 Molecular Formula: C7F5N Molecular Weight (g/mol): 193.07 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

PubChem CID 69882
CAS 773-82-0
Molecular Weight (g/mol) 193.07
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
6

Hexafluorobenzene, 99%

CAS: 392-56-3 Molecular Formula: C6F6 Molecular Weight (g/mol): 186.06 MDL Number: MFCD00000288 InChI Key: ZQBFAOFFOQMSGJ-UHFFFAOYSA-N Synonym: hexafluorobenzene,perfluorobenzene,benzene, hexafluoro,hexafluorbenzol,unii-cmc18t611k,benzene, 1,2,3,4,5,6-hexafluoro,hexa fluorobenzene,hexafluoro benzene,pubchem18879,acmc-1bmus PubChem CID: 9805 ChEBI: CHEBI:38589 IUPAC Name: 1,2,3,4,5,6-hexafluorobenzene SMILES: C1(=C(C(=C(C(=C1F)F)F)F)F)F

PubChem CID 9805
CAS 392-56-3
Molecular Weight (g/mol) 186.06
ChEBI CHEBI:38589
MDL Number MFCD00000288
SMILES C1(=C(C(=C(C(=C1F)F)F)F)F)F
Synonym hexafluorobenzene,perfluorobenzene,benzene, hexafluoro,hexafluorbenzol,unii-cmc18t611k,benzene, 1,2,3,4,5,6-hexafluoro,hexa fluorobenzene,hexafluoro benzene,pubchem18879,acmc-1bmus
IUPAC Name 1,2,3,4,5,6-hexafluorobenzene
InChI Key ZQBFAOFFOQMSGJ-UHFFFAOYSA-N
Molecular Formula C6F6
7

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

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
8

1,2-Diamino-4,5-difluorobenzene, 97%

CAS: 76179-40-3 Molecular Formula: C6H6F2N2 Molecular Weight (g/mol): 144.13 MDL Number: MFCD00061131 InChI Key: PPWRHKISAQTCCG-UHFFFAOYSA-N Synonym: 1,2-diamino-4,5-difluorobenzene,4,5-difluoro-1,2-phenylenediamine,4,5-difluoro-o-phenylenediamine,2-amino-4,5-difluorophenylamine,4,5-difluoro-benzene-1,2-diamine,4,5-difluoro-1,2-benzenediamine,1,2-benzenediamine,4,5-difluoro,1,2-benzenediamine, 4,5-difluoro,pubchem4354,2-amino-4,5-difluoroaniline PubChem CID: 2736755 IUPAC Name: 4,5-difluorobenzene-1,2-diamine SMILES: NC1=CC(F)=C(F)C=C1N

PubChem CID 2736755
CAS 76179-40-3
Molecular Weight (g/mol) 144.13
MDL Number MFCD00061131
SMILES NC1=CC(F)=C(F)C=C1N
Synonym 1,2-diamino-4,5-difluorobenzene,4,5-difluoro-1,2-phenylenediamine,4,5-difluoro-o-phenylenediamine,2-amino-4,5-difluorophenylamine,4,5-difluoro-benzene-1,2-diamine,4,5-difluoro-1,2-benzenediamine,1,2-benzenediamine,4,5-difluoro,1,2-benzenediamine, 4,5-difluoro,pubchem4354,2-amino-4,5-difluoroaniline
IUPAC Name 4,5-difluorobenzene-1,2-diamine
InChI Key PPWRHKISAQTCCG-UHFFFAOYSA-N
Molecular Formula C6H6F2N2
9

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

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
11

4-Fluorobenzyl isocyanate, 98%

CAS: 132740-43-3 Molecular Formula: C8H6FNO Molecular Weight (g/mol): 151.14 MDL Number: MFCD00673062 InChI Key: HHSIWJYERNCLKQ-UHFFFAOYSA-N Synonym: 4-fluorobenzyl isocyanate,1-fluoro-4-isocyanatomethyl benzene,4-fluorobenzylisocyanate,4-fluorophenyl methanisocyanate,4-fluorobezylisocyanate,acmc-1c0to,intermediates-zcf02017,4-fluoro benzyl isocyanate,4-fluorophenyl methyl isocyanate PubChem CID: 2733376 IUPAC Name: 1-fluoro-4-(isocyanatomethyl)benzene SMILES: FC1=CC=C(CN=C=O)C=C1

PubChem CID 2733376
CAS 132740-43-3
Molecular Weight (g/mol) 151.14
MDL Number MFCD00673062
SMILES FC1=CC=C(CN=C=O)C=C1
Synonym 4-fluorobenzyl isocyanate,1-fluoro-4-isocyanatomethyl benzene,4-fluorobenzylisocyanate,4-fluorophenyl methanisocyanate,4-fluorobezylisocyanate,acmc-1c0to,intermediates-zcf02017,4-fluoro benzyl isocyanate,4-fluorophenyl methyl isocyanate
IUPAC Name 1-fluoro-4-(isocyanatomethyl)benzene
InChI Key HHSIWJYERNCLKQ-UHFFFAOYSA-N
Molecular Formula C8H6FNO
12

1-Bromo-3-chloro-5-fluorobenzene, 98%, Thermo Scientific™

CAS: 33863-76-2 Molecular Formula: C6H3BrClF Molecular Weight (g/mol): 209.45 InChI Key: GGMDFPMASIXEIR-UHFFFAOYSA-N Synonym: 3-chloro-5-fluorobromobenzene,1-bromo3-chloro-5-fluorobenzene,1-bromo-3-chloro-5-fluoro-benzene,benzene, 1-bromo-3-chloro-5-fluoro,1,3,5-fluorochlorobromobenzene,pubchem2261,acmc-209i3i,ksc494q7t,3-chloro-5-fluoro-bromobenzene,1-bromo-3-chloro-5-flurobenzene PubChem CID: 2736223 IUPAC Name: 1-bromo-3-chloro-5-fluorobenzene SMILES: C1=C(C=C(C=C1Cl)Br)F

PubChem CID 2736223
CAS 33863-76-2
Molecular Weight (g/mol) 209.45
SMILES C1=C(C=C(C=C1Cl)Br)F
Synonym 3-chloro-5-fluorobromobenzene,1-bromo3-chloro-5-fluorobenzene,1-bromo-3-chloro-5-fluoro-benzene,benzene, 1-bromo-3-chloro-5-fluoro,1,3,5-fluorochlorobromobenzene,pubchem2261,acmc-209i3i,ksc494q7t,3-chloro-5-fluoro-bromobenzene,1-bromo-3-chloro-5-flurobenzene
IUPAC Name 1-bromo-3-chloro-5-fluorobenzene
InChI Key GGMDFPMASIXEIR-UHFFFAOYSA-N
Molecular Formula C6H3BrClF
13

2,6-Difluoroaniline, 97%

CAS: 5509-65-9 Molecular Formula: C6H5F2N Molecular Weight (g/mol): 129.11 MDL Number: MFCD00007655 InChI Key: ODUZJBKKYBQIBX-UHFFFAOYSA-N Synonym: benzenamine, 2,6-difluoro,2,6-difluoro-phenylamine,2,6-difluoro aniline,2,6-difluorobenzenamine,2,6-difluoranilin,2,6 difluoroaniline,2,6-diflouroaniline,pubchem4034,2,6-difuluoroaniline PubChem CID: 79647 IUPAC Name: 2,6-difluoroaniline SMILES: NC1=C(F)C=CC=C1F

PubChem CID 79647
CAS 5509-65-9
Molecular Weight (g/mol) 129.11
MDL Number MFCD00007655
SMILES NC1=C(F)C=CC=C1F
Synonym benzenamine, 2,6-difluoro,2,6-difluoro-phenylamine,2,6-difluoro aniline,2,6-difluorobenzenamine,2,6-difluoranilin,2,6 difluoroaniline,2,6-diflouroaniline,pubchem4034,2,6-difuluoroaniline
IUPAC Name 2,6-difluoroaniline
InChI Key ODUZJBKKYBQIBX-UHFFFAOYSA-N
Molecular Formula C6H5F2N
15

1-Ethynyl-4-fluorobenzene, 98%

CAS: 766-98-3 Molecular Formula: C8H5F Molecular Weight (g/mol): 120.13 MDL Number: MFCD00168823 InChI Key: QXSWHQGIEKUBAS-UHFFFAOYSA-N Synonym: 4-fluorophenylacetylene,benzene, 1-ethynyl-4-fluoro,1-ethynyl-4-fluoro-benzene,4'-fluorophenyl acetylene,p-fluorophenyl acetylene,4'-fluorophenylacetylene,pubchem16719,4-fluorophenyl acetylene,4-fluoro phenylacetylene PubChem CID: 522627 IUPAC Name: 1-ethynyl-4-fluorobenzene SMILES: C#CC1=CC=C(C=C1)F

PubChem CID 522627
CAS 766-98-3
Molecular Weight (g/mol) 120.13
MDL Number MFCD00168823
SMILES C#CC1=CC=C(C=C1)F
Synonym 4-fluorophenylacetylene,benzene, 1-ethynyl-4-fluoro,1-ethynyl-4-fluoro-benzene,4'-fluorophenyl acetylene,p-fluorophenyl acetylene,4'-fluorophenylacetylene,pubchem16719,4-fluorophenyl acetylene,4-fluoro phenylacetylene
IUPAC Name 1-ethynyl-4-fluorobenzene
InChI Key QXSWHQGIEKUBAS-UHFFFAOYSA-N
Molecular Formula C8H5F