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-Bromo-2-isopropoxybenzene, 97%

CAS: 701-07-5 Molecular Formula: C9H11BrO Molecular Weight (g/mol): 215.09 MDL Number: MFCD00070759 InChI Key: MMORVPBHAHXAHH-UHFFFAOYSA-N Synonym: 1-bromo-2-isopropoxybenzene,2-2'-bromophenoxy propane,1-bromo-2-propan-2-yloxy benzene,1-bromo-2-isopropoxy benzene,2-2-bromophenoxy propane,o-bromoisopropoxybenzene,2-bromoisopropoxybenzene,1-bromo-2-1-methylethoxy benzene,2-bromophenyl isopropyl ether,pubchem3828 PubChem CID: 21925427 IUPAC Name: 1-bromo-2-propan-2-yloxybenzene SMILES: CC(C)OC1=CC=CC=C1Br

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PubChem CID	21925427
CAS	701-07-5
Molecular Weight (g/mol)	215.09
MDL Number	MFCD00070759
SMILES	CC(C)OC1=CC=CC=C1Br
Synonym	1-bromo-2-isopropoxybenzene,2-2'-bromophenoxy propane,1-bromo-2-propan-2-yloxy benzene,1-bromo-2-isopropoxy benzene,2-2-bromophenoxy propane,o-bromoisopropoxybenzene,2-bromoisopropoxybenzene,1-bromo-2-1-methylethoxy benzene,2-bromophenyl isopropyl ether,pubchem3828
IUPAC Name	1-bromo-2-propan-2-yloxybenzene
InChI Key	MMORVPBHAHXAHH-UHFFFAOYSA-N
Molecular Formula	C9H11BrO

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2-Bromophenyl isocyanate, 97%

CAS: 1592-00-3 Molecular Formula: C7H4BrNO Molecular Weight (g/mol): 198.019 MDL Number: MFCD00001995 InChI Key: GOOVAYJIVMBWPP-UHFFFAOYSA-N Synonym: 2-bromophenyl isocyanate,2-bromophenylisocyanate,benzene, 1-bromo-2-isocyanato,isocyanic acid 2-bromophenyl ester,2-bromobenzenisocyanate,2bromophenylisocyanate,2-bromophenylisocynate,o-bromophenyl isocyanate,acmc-209djl,2-bromo phenylisocyanate PubChem CID: 137097 IUPAC Name: 1-bromo-2-isocyanatobenzene SMILES: C1=CC=C(C(=C1)N=C=O)Br

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PubChem CID	137097
CAS	1592-00-3
Molecular Weight (g/mol)	198.019
MDL Number	MFCD00001995
SMILES	C1=CC=C(C(=C1)N=C=O)Br
Synonym	2-bromophenyl isocyanate,2-bromophenylisocyanate,benzene, 1-bromo-2-isocyanato,isocyanic acid 2-bromophenyl ester,2-bromobenzenisocyanate,2bromophenylisocyanate,2-bromophenylisocynate,o-bromophenyl isocyanate,acmc-209djl,2-bromo phenylisocyanate
IUPAC Name	1-bromo-2-isocyanatobenzene
InChI Key	GOOVAYJIVMBWPP-UHFFFAOYSA-N
Molecular Formula	C7H4BrNO

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1-Bromo-4-tert-butoxybenzene, 98%, Thermo Scientific Chemicals

CAS: 60876-70-2 Molecular Formula: C10H13BrO Molecular Weight (g/mol): 229.117 MDL Number: MFCD00792676 InChI Key: QIWQHUCUWNGYDZ-UHFFFAOYSA-N Synonym: 1-bromo-4-tert-butoxy benzene,1-bromo-4-tert-butoxybenzene,4-tert-butoxybromobenzene,4-bromophenyl tert-butyl ether,1-bromo-4-tert-butoxy-benzene,benzene, 1-bromo-4-1,1-dimethylethoxy,tert-butyl-4-bromophenyl ether,1-bromo-4-2-methylpropan-2-yl oxy benzene,1-tert-butoxy-4-bromobenzene,bromobutoxybenzene PubChem CID: 2763959 IUPAC Name: 1-bromo-4-[(2-methylpropan-2-yl)oxy]benzene SMILES: CC(C)(C)OC1=CC=C(C=C1)Br

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PubChem CID	2763959
CAS	60876-70-2
Molecular Weight (g/mol)	229.117
MDL Number	MFCD00792676
SMILES	CC(C)(C)OC1=CC=C(C=C1)Br
Synonym	1-bromo-4-tert-butoxy benzene,1-bromo-4-tert-butoxybenzene,4-tert-butoxybromobenzene,4-bromophenyl tert-butyl ether,1-bromo-4-tert-butoxy-benzene,benzene, 1-bromo-4-1,1-dimethylethoxy,tert-butyl-4-bromophenyl ether,1-bromo-4-2-methylpropan-2-yl oxy benzene,1-tert-butoxy-4-bromobenzene,bromobutoxybenzene
IUPAC Name	1-bromo-4-[(2-methylpropan-2-yl)oxy]benzene
InChI Key	QIWQHUCUWNGYDZ-UHFFFAOYSA-N
Molecular Formula	C10H13BrO

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Ethyl 4-bromophenylacetate, 98%

CAS: 14062-25-0 Molecular Formula: C10H11BrO2 Molecular Weight (g/mol): 243.1 MDL Number: MFCD00016333 InChI Key: ZFDCWHPNBWPPHG-UHFFFAOYSA-N Synonym: ethyl 4-bromophenylacetate,ethyl 2-4-bromophenyl acetate,4-bromophenylacetic acid ethyl ester,benzeneacetic acid, 4-bromo-, ethyl ester,4-bromo-phenyl-acetic acid ethyl ester,ethyl 4-bromophenyl acetate,4-bromo-benzeneacetic acid ethyl ester,ethyl-4-bromophenylacetate,pubchem20039,acmc-209ckw PubChem CID: 7020609 IUPAC Name: ethyl 2-(4-bromophenyl)acetate SMILES: CCOC(=O)CC1=CC=C(C=C1)Br

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PubChem CID	7020609
CAS	14062-25-0
Molecular Weight (g/mol)	243.1
MDL Number	MFCD00016333
SMILES	CCOC(=O)CC1=CC=C(C=C1)Br
Synonym	ethyl 4-bromophenylacetate,ethyl 2-4-bromophenyl acetate,4-bromophenylacetic acid ethyl ester,benzeneacetic acid, 4-bromo-, ethyl ester,4-bromo-phenyl-acetic acid ethyl ester,ethyl 4-bromophenyl acetate,4-bromo-benzeneacetic acid ethyl ester,ethyl-4-bromophenylacetate,pubchem20039,acmc-209ckw
IUPAC Name	ethyl 2-(4-bromophenyl)acetate
InChI Key	ZFDCWHPNBWPPHG-UHFFFAOYSA-N
Molecular Formula	C10H11BrO2

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Bromobenzene, 99%

CAS: 108-86-1 Molecular Formula: C6H5Br Molecular Weight (g/mol): 157.01 MDL Number: MFCD00000055 InChI Key: QARVLSVVCXYDNA-UHFFFAOYSA-N Synonym: benzene, bromo,monobromobenzene,phenyl bromide,bromo-benzene,1-bromobenzene,phbr,bromo benzene,4-bromobenzene,unii-co4d5j547l,hsdb 47 PubChem CID: 7961 ChEBI: CHEBI:3179 IUPAC Name: bromobenzene SMILES: BrC1=CC=CC=C1

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PubChem CID	7961
CAS	108-86-1
Molecular Weight (g/mol)	157.01
ChEBI	CHEBI:3179
MDL Number	MFCD00000055
SMILES	BrC1=CC=CC=C1
Synonym	benzene, bromo,monobromobenzene,phenyl bromide,bromo-benzene,1-bromobenzene,phbr,bromo benzene,4-bromobenzene,unii-co4d5j547l,hsdb 47
IUPAC Name	bromobenzene
InChI Key	QARVLSVVCXYDNA-UHFFFAOYSA-N
Molecular Formula	C6H5Br

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4-Bromo-2,5-difluoroaniline, 98%, Thermo Scientific Chemicals

CAS: 112279-60-4 Molecular Formula: C6H4BrF2N Molecular Weight (g/mol): 208.006 MDL Number: MFCD01861125 InChI Key: XOYHFIQPPOJMFK-UHFFFAOYSA-N Synonym: 4-bromo-2,5-difluoro-phenylamine,4-bromo-2,5-difluoro-aniline,4-bromo-2,5-difluorophenylamine,pubchem2928,acmc-1bvn4,ksc494m7l,4-bromo-2,5-difluorobenzenamine,2,5-difluoro-4-bromoaniline,4-bromo-2,5-difluoroaniline,benzenamine, 4-bromo-2,5-difluoro PubChem CID: 2773285 IUPAC Name: 4-bromo-2,5-difluoroaniline SMILES: C1=C(C(=CC(=C1F)Br)F)N

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PubChem CID	2773285
CAS	112279-60-4
Molecular Weight (g/mol)	208.006
MDL Number	MFCD01861125
SMILES	C1=C(C(=CC(=C1F)Br)F)N
Synonym	4-bromo-2,5-difluoro-phenylamine,4-bromo-2,5-difluoro-aniline,4-bromo-2,5-difluorophenylamine,pubchem2928,acmc-1bvn4,ksc494m7l,4-bromo-2,5-difluorobenzenamine,2,5-difluoro-4-bromoaniline,4-bromo-2,5-difluoroaniline,benzenamine, 4-bromo-2,5-difluoro
IUPAC Name	4-bromo-2,5-difluoroaniline
InChI Key	XOYHFIQPPOJMFK-UHFFFAOYSA-N
Molecular Formula	C6H4BrF2N

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1-Bromo-4-n-nonylbenzene, 98%

CAS: 51554-94-0 Molecular Formula: C15H23Br Molecular Weight (g/mol): 283.25 MDL Number: MFCD00061116 InChI Key: LVCWOFRWEVUMNY-UHFFFAOYSA-N Synonym: 1-bromo-4-n-nonylbenzene,bromononylbenzene,4-nonylbromobenzene,4-n-nonylbromobenzene,4-nonylphenyl bromide,acmc-209kuh,4-bromo-1-nonylbenzene,1-bromo-4-nonylbenzene PubChem CID: 12603095 IUPAC Name: 1-bromo-4-nonylbenzene SMILES: CCCCCCCCCC1=CC=C(Br)C=C1

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PubChem CID	12603095
CAS	51554-94-0
Molecular Weight (g/mol)	283.25
MDL Number	MFCD00061116
SMILES	CCCCCCCCCC1=CC=C(Br)C=C1
Synonym	1-bromo-4-n-nonylbenzene,bromononylbenzene,4-nonylbromobenzene,4-n-nonylbromobenzene,4-nonylphenyl bromide,acmc-209kuh,4-bromo-1-nonylbenzene,1-bromo-4-nonylbenzene
IUPAC Name	1-bromo-4-nonylbenzene
InChI Key	LVCWOFRWEVUMNY-UHFFFAOYSA-N
Molecular Formula	C15H23Br

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1-Bromo-2,4-dinitrobenzene, 98%

CAS: 584-48-5 Molecular Formula: C6H3BrN2O4 Molecular Weight (g/mol): 247.004 MDL Number: MFCD00041873 InChI Key: PBOPJYORIDJAFE-UHFFFAOYSA-N PubChem CID: 11441 ChEBI: CHEBI:58999 IUPAC Name: 1-bromo-2,4-dinitrobenzene SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Br

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PubChem CID	11441
CAS	584-48-5
Molecular Weight (g/mol)	247.004
ChEBI	CHEBI:58999
MDL Number	MFCD00041873
SMILES	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Br
IUPAC Name	1-bromo-2,4-dinitrobenzene
InChI Key	PBOPJYORIDJAFE-UHFFFAOYSA-N
Molecular Formula	C6H3BrN2O4

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3-Bromo-4-methylbenzonitrile, 97%

CAS: 42872-74-2 Molecular Formula: C8H6BrN Molecular Weight (g/mol): 196.05 MDL Number: MFCD06797818 InChI Key: VXUMRYMTYKDWMO-UHFFFAOYSA-N Synonym: 2-bromo-4-cyanotoluene,4-methyl-3-bromobenzonitrile,benzonitrile, 3-bromo-4-methyl,3-bromo-4-methylbenzenecarbonitrile,3-bromo-4-methyl-benzonitrile,bromo p tolunitrile,bromo-p-tolunitrile,bromo-p-toluonitrile,3-bromo-p-tolunitrile,pubchem11163 PubChem CID: 14004840 IUPAC Name: 3-bromo-4-methylbenzonitrile SMILES: CC1=C(Br)C=C(C=C1)C#N

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PubChem CID	14004840
CAS	42872-74-2
Molecular Weight (g/mol)	196.05
MDL Number	MFCD06797818
SMILES	CC1=C(Br)C=C(C=C1)C#N
Synonym	2-bromo-4-cyanotoluene,4-methyl-3-bromobenzonitrile,benzonitrile, 3-bromo-4-methyl,3-bromo-4-methylbenzenecarbonitrile,3-bromo-4-methyl-benzonitrile,bromo p tolunitrile,bromo-p-tolunitrile,bromo-p-toluonitrile,3-bromo-p-tolunitrile,pubchem11163
IUPAC Name	3-bromo-4-methylbenzonitrile
InChI Key	VXUMRYMTYKDWMO-UHFFFAOYSA-N
Molecular Formula	C8H6BrN

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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

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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

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4-Amino-2-bromobenzonitrile, 95%

CAS: 53312-82-6 Molecular Formula: C7H5BrN2 Molecular Weight (g/mol): 197.04 MDL Number: MFCD03695814 InChI Key: OSYGPHDNNWRFJO-UHFFFAOYSA-N Synonym: 2-bromo-4-aminobenzonitrile,ksc494a6n,benzonitrile, 4-amino-2-bromo PubChem CID: 824602 IUPAC Name: 4-amino-2-bromobenzonitrile SMILES: NC1=CC(Br)=C(C=C1)C#N

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PubChem CID	824602
CAS	53312-82-6
Molecular Weight (g/mol)	197.04
MDL Number	MFCD03695814
SMILES	NC1=CC(Br)=C(C=C1)C#N
Synonym	2-bromo-4-aminobenzonitrile,ksc494a6n,benzonitrile, 4-amino-2-bromo
IUPAC Name	4-amino-2-bromobenzonitrile
InChI Key	OSYGPHDNNWRFJO-UHFFFAOYSA-N
Molecular Formula	C7H5BrN2

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3-Bromoaniline, 98%

CAS: 591-19-5 Molecular Formula: C6H6BrN Molecular Weight (g/mol): 172.03 MDL Number: MFCD00007757 InChI Key: DHYHYLGCQVVLOQ-UHFFFAOYSA-N Synonym: m-bromoaniline,benzenamine, 3-bromo,3-bromo aniline,m-aminobromobenzene,aniline, m-bromo,3-bromobenzenamine,3-bromophenylamine,bromoaniline 3-,3-bromo-benzenamine,3-bromo-phenylamine PubChem CID: 11562 IUPAC Name: 3-bromoaniline SMILES: NC1=CC=CC(Br)=C1

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PubChem CID	11562
CAS	591-19-5
Molecular Weight (g/mol)	172.03
MDL Number	MFCD00007757
SMILES	NC1=CC=CC(Br)=C1
Synonym	m-bromoaniline,benzenamine, 3-bromo,3-bromo aniline,m-aminobromobenzene,aniline, m-bromo,3-bromobenzenamine,3-bromophenylamine,bromoaniline 3-,3-bromo-benzenamine,3-bromo-phenylamine
IUPAC Name	3-bromoaniline
InChI Key	DHYHYLGCQVVLOQ-UHFFFAOYSA-N
Molecular Formula	C6H6BrN

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3-Bromobenzonitrile, 99%

CAS: 6952-59-6 Molecular Formula: C7H4BrN Molecular Weight (g/mol): 182.02 MDL Number: MFCD00001796 InChI Key: STXAVEHFKAXGOX-UHFFFAOYSA-N Synonym: m-bromobenzonitrile,benzonitrile, 3-bromo,benzonitrile, m-bromo,3-cyanobromobenzene,1-bromo-3-cyanobenzene,3-bromobenzenecarbonitrile,3-bromo benzonitrile,3-bromobenzonitride,m-brombenzonitril,3-brombenzonitrile PubChem CID: 23381 IUPAC Name: 3-bromobenzonitrile SMILES: BrC1=CC=CC(=C1)C#N

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PubChem CID	23381
CAS	6952-59-6
Molecular Weight (g/mol)	182.02
MDL Number	MFCD00001796
SMILES	BrC1=CC=CC(=C1)C#N
Synonym	m-bromobenzonitrile,benzonitrile, 3-bromo,benzonitrile, m-bromo,3-cyanobromobenzene,1-bromo-3-cyanobenzene,3-bromobenzenecarbonitrile,3-bromo benzonitrile,3-bromobenzonitride,m-brombenzonitril,3-brombenzonitrile
IUPAC Name	3-bromobenzonitrile
InChI Key	STXAVEHFKAXGOX-UHFFFAOYSA-N
Molecular Formula	C7H4BrN

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3-Bromotoluene, 98%

CAS: 591-17-3 Molecular Formula: C7H7Br Molecular Weight (g/mol): 171.04 MDL Number: MFCD00000085 InChI Key: WJIFKOVZNJTSGO-UHFFFAOYSA-N Synonym: 3-bromotoluene,m-bromotoluene,3-methylbromobenzene,benzene, 1-bromo-3-methyl,m-tolyl bromide,toluene, m-bromo,5-bromotoluene,3-bromo-1-methylbenzene,m-methylbromobenzene,3-methyl-1-bromobenzene PubChem CID: 11560 IUPAC Name: 1-bromo-3-methylbenzene SMILES: CC1=CC=CC(Br)=C1

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PubChem CID	11560
CAS	591-17-3
Molecular Weight (g/mol)	171.04
MDL Number	MFCD00000085
SMILES	CC1=CC=CC(Br)=C1
Synonym	3-bromotoluene,m-bromotoluene,3-methylbromobenzene,benzene, 1-bromo-3-methyl,m-tolyl bromide,toluene, m-bromo,5-bromotoluene,3-bromo-1-methylbenzene,m-methylbromobenzene,3-methyl-1-bromobenzene
IUPAC Name	1-bromo-3-methylbenzene
InChI Key	WJIFKOVZNJTSGO-UHFFFAOYSA-N
Molecular Formula	C7H7Br

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3-(3-Bromophenyl)-1H-pyrazole, 98%, Thermo Scientific Chemicals

CAS: 149739-65-1 Molecular Formula: C9H7BrN2 Molecular Weight (g/mol): 223.07 MDL Number: MFCD01940433 InChI Key: NVRXIZHZQPRBKL-UHFFFAOYSA-N Synonym: 3-3-bromophenyl-1h-pyrazole,5-3-bromophenyl-1h-pyrazole,5-3-bromo-phenyl-1h-pyrazole,3-3-bromophenyl pyrazole,3-3-bromophenyl-2h-pyrazole,1h-pyrazole, 3-3-bromophenyl,1-bromo-3-1h-pyrazol-3-yl benzene,5-3-bromophenyl pyrazole,acmc-1c2w8,ksc494i0r PubChem CID: 2735613 IUPAC Name: 5-(3-bromophenyl)-1H-pyrazole SMILES: BrC1=CC=CC(=C1)C1=CC=NN1

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Specifications

PubChem CID	2735613
CAS	149739-65-1
Molecular Weight (g/mol)	223.07
MDL Number	MFCD01940433
SMILES	BrC1=CC=CC(=C1)C1=CC=NN1
Synonym	3-3-bromophenyl-1h-pyrazole,5-3-bromophenyl-1h-pyrazole,5-3-bromo-phenyl-1h-pyrazole,3-3-bromophenyl pyrazole,3-3-bromophenyl-2h-pyrazole,1h-pyrazole, 3-3-bromophenyl,1-bromo-3-1h-pyrazol-3-yl benzene,5-3-bromophenyl pyrazole,acmc-1c2w8,ksc494i0r
IUPAC Name	5-(3-bromophenyl)-1H-pyrazole
InChI Key	NVRXIZHZQPRBKL-UHFFFAOYSA-N
Molecular Formula	C9H7BrN2

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