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Bromobenzenes

Organic compounds considered aryl halides that consist of a phenyl group with a bromine atom substitution in the following structure: C₆H₅Br.
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1

Ethyl alpha,4-dibromophenylacetate, 97+%

CAS: 77143-76-1 Molecular Formula: C10H10Br2O2 Molecular Weight (g/mol): 321.996 MDL Number: MFCD09953497 InChI Key: PPRAWWBOUOBAON-UHFFFAOYSA-N Synonym: ethyl 2-bromo-2-4-bromophenyl acetate,ethyl 2-bromo-4-bromophenyl acetate,ethyl bromo 4-bromophenyl acetate,alpha,4-dibromophenylacetic acid ethyl ester,ethyl alpha,4-dibromophenylacetate,ethyl2-bromo-2-4-bromophenyl acetate,ethyl 2-bromanyl-2-4-bromophenyl ethanoate,benzeneacetic acid, ?,4-dibromo-, ethyl ester,benzeneacetic acid, a,4-dibromo-, ethyl ester PubChem CID: 12754876 IUPAC Name: ethyl 2-bromo-2-(4-bromophenyl)acetate SMILES: CCOC(=O)C(C1=CC=C(C=C1)Br)Br

PubChem CID 12754876
CAS 77143-76-1
Molecular Weight (g/mol) 321.996
MDL Number MFCD09953497
SMILES CCOC(=O)C(C1=CC=C(C=C1)Br)Br
Synonym ethyl 2-bromo-2-4-bromophenyl acetate,ethyl 2-bromo-4-bromophenyl acetate,ethyl bromo 4-bromophenyl acetate,alpha,4-dibromophenylacetic acid ethyl ester,ethyl alpha,4-dibromophenylacetate,ethyl2-bromo-2-4-bromophenyl acetate,ethyl 2-bromanyl-2-4-bromophenyl ethanoate,benzeneacetic acid, ?,4-dibromo-, ethyl ester,benzeneacetic acid, a,4-dibromo-, ethyl ester
IUPAC Name ethyl 2-bromo-2-(4-bromophenyl)acetate
InChI Key PPRAWWBOUOBAON-UHFFFAOYSA-N
Molecular Formula C10H10Br2O2
2

2-Bromo-alpha-methylbenzyl alcohol, 99%

CAS: 5411-56-3 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.06 MDL Number: MFCD00065001 InChI Key: DZLZSFZSPIUINR-UHFFFAOYSA-N Synonym: 1-2-bromophenyl ethanol,2-bromo-alpha-methylbenzyl alcohol,1-2-bromophenyl ethan-1-ol,1-2'-bromophenyl-1-hydroxyethane,acmc-209wki,o-bromo-1-phenylethanol,o-bromo-1-phenyl ethanol,acmc-209y6n,1-2-bro-mophenyl ethanol,1-2-bromo-phenyl-ethanol PubChem CID: 95455 IUPAC Name: 1-(2-bromophenyl)ethanol SMILES: CC(C1=CC=CC=C1Br)O

PubChem CID 95455
CAS 5411-56-3
Molecular Weight (g/mol) 201.06
MDL Number MFCD00065001
SMILES CC(C1=CC=CC=C1Br)O
Synonym 1-2-bromophenyl ethanol,2-bromo-alpha-methylbenzyl alcohol,1-2-bromophenyl ethan-1-ol,1-2'-bromophenyl-1-hydroxyethane,acmc-209wki,o-bromo-1-phenylethanol,o-bromo-1-phenyl ethanol,acmc-209y6n,1-2-bro-mophenyl ethanol,1-2-bromo-phenyl-ethanol
IUPAC Name 1-(2-bromophenyl)ethanol
InChI Key DZLZSFZSPIUINR-UHFFFAOYSA-N
Molecular Formula C8H9BrO
3

(R)-3-Bromo-alpha-methylbenzyl alcohol, 95%, 98% ee

CAS: 134615-24-0 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.06 MDL Number: MFCD06658929 InChI Key: ULMJQMDYAOJNCC-ZCFIWIBFSA-N Synonym: r-1-3-bromophenyl ethanol,1r-1-3-bromophenyl ethanol,1r-1-3-bromophenyl ethan-1-ol,pubchem15565,r-1-m-bromophenyl ethanol,r-1-3-bromo-phenyl-ethanol,r-3-bromo-alpha-methylbenzyl alcohol,benzenemethanol, 3-bromo-a-methyl-, ar PubChem CID: 2734889 IUPAC Name: (1R)-1-(3-bromophenyl)ethanol SMILES: CC(C1=CC(=CC=C1)Br)O

PubChem CID 2734889
CAS 134615-24-0
Molecular Weight (g/mol) 201.06
MDL Number MFCD06658929
SMILES CC(C1=CC(=CC=C1)Br)O
Synonym r-1-3-bromophenyl ethanol,1r-1-3-bromophenyl ethanol,1r-1-3-bromophenyl ethan-1-ol,pubchem15565,r-1-m-bromophenyl ethanol,r-1-3-bromo-phenyl-ethanol,r-3-bromo-alpha-methylbenzyl alcohol,benzenemethanol, 3-bromo-a-methyl-, ar
IUPAC Name (1R)-1-(3-bromophenyl)ethanol
InChI Key ULMJQMDYAOJNCC-ZCFIWIBFSA-N
Molecular Formula C8H9BrO
5

1-Bromo-2-fluoro-5-(trifluoromethoxy)benzene, 98%

CAS: 286932-57-8 Molecular Formula: C7H3BrF4O Molecular Weight (g/mol): 258.998 MDL Number: MFCD02181186 InChI Key: VVVFPEJORKPEST-UHFFFAOYSA-N Synonym: 2-bromo-1-fluoro-4-trifluoromethoxy benzene,1-bromo-2-fluoro-5-trifluoromethoxy benzene,3-bromo-4-fluoro trifluoromethoxy benzene,3-bromo-4-fluorotrifluoroanisole,2-fluoro-5-trifluoromethoxy-bromobenzene,3-bromo-4-fluorophenyl trifluoromethyl ether,3-bromo-4-fluoro-alpha,alpha,alpha-trifluoroanisole,3-bromo-4-fluorotrifluoromethoxybenzene,pubchem12363,acmc-1cocq PubChem CID: 25067359 IUPAC Name: 2-bromo-1-fluoro-4-(trifluoromethoxy)benzene SMILES: C1=CC(=C(C=C1OC(F)(F)F)Br)F

PubChem CID 25067359
CAS 286932-57-8
Molecular Weight (g/mol) 258.998
MDL Number MFCD02181186
SMILES C1=CC(=C(C=C1OC(F)(F)F)Br)F
Synonym 2-bromo-1-fluoro-4-trifluoromethoxy benzene,1-bromo-2-fluoro-5-trifluoromethoxy benzene,3-bromo-4-fluoro trifluoromethoxy benzene,3-bromo-4-fluorotrifluoroanisole,2-fluoro-5-trifluoromethoxy-bromobenzene,3-bromo-4-fluorophenyl trifluoromethyl ether,3-bromo-4-fluoro-alpha,alpha,alpha-trifluoroanisole,3-bromo-4-fluorotrifluoromethoxybenzene,pubchem12363,acmc-1cocq
IUPAC Name 2-bromo-1-fluoro-4-(trifluoromethoxy)benzene
InChI Key VVVFPEJORKPEST-UHFFFAOYSA-N
Molecular Formula C7H3BrF4O
6

1-Bromo-3-(trifluoromethoxy)benzene, 98+%, Thermo Scientific Chemicals

CAS: 2252-44-0 Molecular Formula: C7H4BrF3O Molecular Weight (g/mol): 241.007 MDL Number: MFCD00040943 InChI Key: WVUDHWBCPSXAFN-UHFFFAOYSA-N Synonym: 1-bromo-3-trifluoromethoxy benzene,3-trifluoromethoxy bromobenzene,3-bromo trifluoromethoxy benzene,m-bromo trifluoromethoxy benzene,3-bromo-1-trifluoromethoxy benzene,benzene, 1-bromo-3-trifluoromethoxy,3-bromo-alpha,alpha,alpha-trifluoroanisole,bromo-3-trifluoromethoxy benzene,buttpark 91\57-27,1-bromo-3-trifluoromethoxy-benzene PubChem CID: 519964 IUPAC Name: 1-bromo-3-(trifluoromethoxy)benzene SMILES: C1=CC(=CC(=C1)Br)OC(F)(F)F

PubChem CID 519964
CAS 2252-44-0
Molecular Weight (g/mol) 241.007
MDL Number MFCD00040943
SMILES C1=CC(=CC(=C1)Br)OC(F)(F)F
Synonym 1-bromo-3-trifluoromethoxy benzene,3-trifluoromethoxy bromobenzene,3-bromo trifluoromethoxy benzene,m-bromo trifluoromethoxy benzene,3-bromo-1-trifluoromethoxy benzene,benzene, 1-bromo-3-trifluoromethoxy,3-bromo-alpha,alpha,alpha-trifluoroanisole,bromo-3-trifluoromethoxy benzene,buttpark 91\57-27,1-bromo-3-trifluoromethoxy-benzene
IUPAC Name 1-bromo-3-(trifluoromethoxy)benzene
InChI Key WVUDHWBCPSXAFN-UHFFFAOYSA-N
Molecular Formula C7H4BrF3O
7

(+/-)-1-(4-Bromophenyl)ethylamine, 96%

CAS: 24358-62-1 Molecular Formula: C8H10BrN Molecular Weight (g/mol): 200.079 MDL Number: MFCD00025548 InChI Key: SOZMSEPDYJGBEK-UHFFFAOYSA-N Synonym: 1-4-bromophenyl ethylamine,1-4-bromophenyl ethanamine,4-bromo-alpha-methylbenzylamine,4-bromo-alpha-phenethylamine,1-4-bromophenyl ethan-1-amine,1-4-bromophenyl ethyl amine,--1-4-bromophenyl ethylamine,+-p-bromo-.alpha.-phenethylamine,1-amino-1-4-bromophenyl ethane,+/--1-4-bromophenyl ethylamine PubChem CID: 91175 IUPAC Name: 1-(4-bromophenyl)ethanamine SMILES: CC(C1=CC=C(C=C1)Br)N

PubChem CID 91175
CAS 24358-62-1
Molecular Weight (g/mol) 200.079
MDL Number MFCD00025548
SMILES CC(C1=CC=C(C=C1)Br)N
Synonym 1-4-bromophenyl ethylamine,1-4-bromophenyl ethanamine,4-bromo-alpha-methylbenzylamine,4-bromo-alpha-phenethylamine,1-4-bromophenyl ethan-1-amine,1-4-bromophenyl ethyl amine,--1-4-bromophenyl ethylamine,+-p-bromo-.alpha.-phenethylamine,1-amino-1-4-bromophenyl ethane,+/--1-4-bromophenyl ethylamine
IUPAC Name 1-(4-bromophenyl)ethanamine
InChI Key SOZMSEPDYJGBEK-UHFFFAOYSA-N
Molecular Formula C8H10BrN
8

4-Bromomandelic acid, 98+%

CAS: 6940-50-7 Molecular Formula: C8H7BrO3 Molecular Weight (g/mol): 231.05 MDL Number: MFCD00004232 InChI Key: BHZBRPQOYFDTAB-UHFFFAOYNA-N Synonym: 4-bromomandelic acid,2-4-bromophenyl-2-hydroxyacetic acid,p-bromomandelic acid,p-bromo mandelic acid,4-bromo-dl-mandelic acid,benzeneacetic acid, 4-bromo-.alpha.-hydroxy,4-bromophenyl hydroxy acetic acid,4-bromo-alpha-hydroxyphenylacetic acid,4-bromo-hydroxybenzeneaceticacid,mandelic acid, p-bromo PubChem CID: 97930 IUPAC Name: 2-(4-bromophenyl)-2-hydroxyacetic acid SMILES: OC(C(O)=O)C1=CC=C(Br)C=C1

PubChem CID 97930
CAS 6940-50-7
Molecular Weight (g/mol) 231.05
MDL Number MFCD00004232
SMILES OC(C(O)=O)C1=CC=C(Br)C=C1
Synonym 4-bromomandelic acid,2-4-bromophenyl-2-hydroxyacetic acid,p-bromomandelic acid,p-bromo mandelic acid,4-bromo-dl-mandelic acid,benzeneacetic acid, 4-bromo-.alpha.-hydroxy,4-bromophenyl hydroxy acetic acid,4-bromo-alpha-hydroxyphenylacetic acid,4-bromo-hydroxybenzeneaceticacid,mandelic acid, p-bromo
IUPAC Name 2-(4-bromophenyl)-2-hydroxyacetic acid
InChI Key BHZBRPQOYFDTAB-UHFFFAOYNA-N
Molecular Formula C8H7BrO3
9

(R)-(+)-1-(2-Bromophenyl)ethanol, 98%

CAS: 76116-20-6 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.063 MDL Number: MFCD00216591 InChI Key: DZLZSFZSPIUINR-ZCFIWIBFSA-N Synonym: r-1-2-bromophenyl ethanol,1r-1-2-bromophenyl ethanol,1r-1-2-bromophenyl ethan-1-ol,pubchem5686,r-+-1-2-bromophenyl ethanol,r-+-2-bromo-,a-methylbenzyl alcohol,benzenemethanol,2-bromo-a-methyl-, ar,r-+-2-bromo-alpha-methylbenzyl alcohol,r-+-2-bromo-alpha-methylbenzyl alcoh PubChem CID: 2734868 IUPAC Name: (1R)-1-(2-bromophenyl)ethanol SMILES: CC(C1=CC=CC=C1Br)O

PubChem CID 2734868
CAS 76116-20-6
Molecular Weight (g/mol) 201.063
MDL Number MFCD00216591
SMILES CC(C1=CC=CC=C1Br)O
Synonym r-1-2-bromophenyl ethanol,1r-1-2-bromophenyl ethanol,1r-1-2-bromophenyl ethan-1-ol,pubchem5686,r-+-1-2-bromophenyl ethanol,r-+-2-bromo-,a-methylbenzyl alcohol,benzenemethanol,2-bromo-a-methyl-, ar,r-+-2-bromo-alpha-methylbenzyl alcohol,r-+-2-bromo-alpha-methylbenzyl alcoh
IUPAC Name (1R)-1-(2-bromophenyl)ethanol
InChI Key DZLZSFZSPIUINR-ZCFIWIBFSA-N
Molecular Formula C8H9BrO
10

4-Bromobenzyl mercaptan, 98%

CAS: 19552-10-4 Molecular Formula: C7H7BrS Molecular Weight (g/mol): 203.097 MDL Number: MFCD03701566 InChI Key: CUCKXDPCCYHFMQ-UHFFFAOYSA-N Synonym: 4-bromobenzyl mercaptan,4-bromophenyl methanethiol,4-bromobenzylmercaptan,4-bromophenyl methane-1-thiol,acmc-20ammu,pubchem6868,4-bromo-a-toluenethiol,4-bromo-,a-toluenethiol,4-bromo-alpha-toluenethiol PubChem CID: 271218 IUPAC Name: (4-bromophenyl)methanethiol SMILES: C1=CC(=CC=C1CS)Br

PubChem CID 271218
CAS 19552-10-4
Molecular Weight (g/mol) 203.097
MDL Number MFCD03701566
SMILES C1=CC(=CC=C1CS)Br
Synonym 4-bromobenzyl mercaptan,4-bromophenyl methanethiol,4-bromobenzylmercaptan,4-bromophenyl methane-1-thiol,acmc-20ammu,pubchem6868,4-bromo-a-toluenethiol,4-bromo-,a-toluenethiol,4-bromo-alpha-toluenethiol
IUPAC Name (4-bromophenyl)methanethiol
InChI Key CUCKXDPCCYHFMQ-UHFFFAOYSA-N
Molecular Formula C7H7BrS
11

(R)-(+)-1-(4-Bromophenyl)ethylamine, ChiPros, 99%, ee 98%

CAS: 45791-36-4 Molecular Formula: C8H10BrN Molecular Weight (g/mol): 200.079 MDL Number: MFCD00066025 InChI Key: SOZMSEPDYJGBEK-ZCFIWIBFSA-N Synonym: r-1-4-bromophenyl ethylamine,r-+-1-4-bromophenyl ethylamine,r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethan-1-amine,r-1-4-bromophenyl-ethylamine,r-4-bromo-alpha-methylbenzylamine,r-+-4-bromo a-methylbenzylamine,p-bromo-a-methylbenzylamine,pubchem14234 PubChem CID: 853000 IUPAC Name: (1R)-1-(4-bromophenyl)ethanamine SMILES: CC(C1=CC=C(C=C1)Br)N

PubChem CID 853000
CAS 45791-36-4
Molecular Weight (g/mol) 200.079
MDL Number MFCD00066025
SMILES CC(C1=CC=C(C=C1)Br)N
Synonym r-1-4-bromophenyl ethylamine,r-+-1-4-bromophenyl ethylamine,r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethan-1-amine,r-1-4-bromophenyl-ethylamine,r-4-bromo-alpha-methylbenzylamine,r-+-4-bromo a-methylbenzylamine,p-bromo-a-methylbenzylamine,pubchem14234
IUPAC Name (1R)-1-(4-bromophenyl)ethanamine
InChI Key SOZMSEPDYJGBEK-ZCFIWIBFSA-N
Molecular Formula C8H10BrN
12

Alfa Aesar™ 5-(2-Bromophenyl)-1H-tetrazole, 98+%

CAS: 73096-42-1 Molecular Formula: C7H5BrN4 Molecular Weight (g/mol): 225.049 MDL Number: MFCD00151799 InChI Key: YHVBXKTXLJTDRI-UHFFFAOYSA-N PubChem CID: 560689 IUPAC Name: 5-(2-bromophenyl)-2H-tetrazole SMILES: C1=CC=C(C(=C1)C2=NNN=N2)Br

PubChem CID 560689
CAS 73096-42-1
Molecular Weight (g/mol) 225.049
MDL Number MFCD00151799
SMILES C1=CC=C(C(=C1)C2=NNN=N2)Br
IUPAC Name 5-(2-bromophenyl)-2H-tetrazole
InChI Key YHVBXKTXLJTDRI-UHFFFAOYSA-N
Molecular Formula C7H5BrN4
13

Alfa Aesar™ 4-Bromo-2,6-difluorobenzonitrile, 95%

CAS: 123843-67-4 Molecular Formula: C7H2BrF2N Molecular Weight (g/mol): 218.00 MDL Number: MFCD01310981 InChI Key: TZHQWUAOIWRFSW-UHFFFAOYSA-N Synonym: 4-bromo-2,6-difluoro-benzonitrile,2,6-difluoro-4-bromobenzonitrile,benzonitrile, 4-bromo-2,6-difluoro,4-bromo-2,6-difluorobenzenecarbonitrile,pubchem4699,acmc-1bymk,ksc513m5d,4-bromo-2,6-difluoro-bezonitrile,2,6-difluoro-4-bromo-benzonitrile PubChem CID: 2756916 IUPAC Name: 4-bromo-2,6-difluorobenzonitrile SMILES: FC1=CC(Br)=CC(F)=C1C#N

PubChem CID 2756916
CAS 123843-67-4
Molecular Weight (g/mol) 218.00
MDL Number MFCD01310981
SMILES FC1=CC(Br)=CC(F)=C1C#N
Synonym 4-bromo-2,6-difluoro-benzonitrile,2,6-difluoro-4-bromobenzonitrile,benzonitrile, 4-bromo-2,6-difluoro,4-bromo-2,6-difluorobenzenecarbonitrile,pubchem4699,acmc-1bymk,ksc513m5d,4-bromo-2,6-difluoro-bezonitrile,2,6-difluoro-4-bromo-benzonitrile
IUPAC Name 4-bromo-2,6-difluorobenzonitrile
InChI Key TZHQWUAOIWRFSW-UHFFFAOYSA-N
Molecular Formula C7H2BrF2N
14

4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene, 97%, Thermo Scientific™

CAS: 105529-58-6 Molecular Formula: C7H3BrF4O Molecular Weight (g/mol): 258.998 MDL Number: MFCD01861132 InChI Key: SBSFDYRKNUCGBZ-UHFFFAOYSA-N Synonym: 4-bromo-2-fluoro-1-trifluoromethoxy benzene,1-bromo-3-fluoro-4-trifluoromethoxy benzene,1-bromo-3-fluoro-4-trifluoromethoxybenzene,2-fluoro-4-bromotrifluoromethoxybenzene,4-bromo-2-fluorotrifluoromethoxybenzene,benzene, 4-bromo-2-fluoro-1-trifluoromethoxy,3-fluoro-4-trifluoromethoxy bromobenzene,3-bromo-2-fluorotrifluoromethoxybenzene,4-bromo-2-fluorophenyl trifluoromethyl ether,4-bromo-alpha,alpha,alpha,2-tetrafluoroanisole PubChem CID: 2782217 IUPAC Name: 4-bromo-2-fluoro-1-(trifluoromethoxy)benzene SMILES: C1=CC(=C(C=C1Br)F)OC(F)(F)F

PubChem CID 2782217
CAS 105529-58-6
Molecular Weight (g/mol) 258.998
MDL Number MFCD01861132
SMILES C1=CC(=C(C=C1Br)F)OC(F)(F)F
Synonym 4-bromo-2-fluoro-1-trifluoromethoxy benzene,1-bromo-3-fluoro-4-trifluoromethoxy benzene,1-bromo-3-fluoro-4-trifluoromethoxybenzene,2-fluoro-4-bromotrifluoromethoxybenzene,4-bromo-2-fluorotrifluoromethoxybenzene,benzene, 4-bromo-2-fluoro-1-trifluoromethoxy,3-fluoro-4-trifluoromethoxy bromobenzene,3-bromo-2-fluorotrifluoromethoxybenzene,4-bromo-2-fluorophenyl trifluoromethyl ether,4-bromo-alpha,alpha,alpha,2-tetrafluoroanisole
IUPAC Name 4-bromo-2-fluoro-1-(trifluoromethoxy)benzene
InChI Key SBSFDYRKNUCGBZ-UHFFFAOYSA-N
Molecular Formula C7H3BrF4O
15

3-Bromo-5-(trifluoromethoxy)benzonitrile, 97%, Thermo Scientific™

CAS: 914635-52-2 Molecular Formula: C8H3BrF3NO Molecular Weight (g/mol): 266.017 MDL Number: MFCD08458074 InChI Key: PQPKERBGCBHRJO-UHFFFAOYSA-N Synonym: 3-bromo-5-trifluoromethoxy benzonitrile,5-bromo-3-trifluoromethoxy benzenecarbonitrile,3-bromo-5-cyano-alpha,alpha,alpha-trifluoroanisole PubChem CID: 44717376 IUPAC Name: 3-bromo-5-(trifluoromethoxy)benzonitrile SMILES: C1=C(C=C(C=C1OC(F)(F)F)Br)C#N

PubChem CID 44717376
CAS 914635-52-2
Molecular Weight (g/mol) 266.017
MDL Number MFCD08458074
SMILES C1=C(C=C(C=C1OC(F)(F)F)Br)C#N
Synonym 3-bromo-5-trifluoromethoxy benzonitrile,5-bromo-3-trifluoromethoxy benzenecarbonitrile,3-bromo-5-cyano-alpha,alpha,alpha-trifluoroanisole
IUPAC Name 3-bromo-5-(trifluoromethoxy)benzonitrile
InChI Key PQPKERBGCBHRJO-UHFFFAOYSA-N
Molecular Formula C8H3BrF3NO