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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1-Bromo-4-ethynylbenzene, 98%

CAS: 766-96-1 Molecular Formula: C₈H₅Br Molecular Weight (g/mol): 181.03 InChI Key: LTLVZQZDXQWLHU-UHFFFAOYSA-N Synonym: 4-bromophenylacetylene,benzene, 1-bromo-4-ethynyl,1-bromo-4-ethynyl-benzene,4-bromophenyl acetylene,4'-bromophenyl acetylene,4'-bromophenylacetylene,p-bromophenylacetylene,p-bromophenyl acetylene,4-bromphenyl acetylene,4-bromo-1-ethynylbenzene PubChem CID: 136603 IUPAC Name: 1-bromo-4-ethynylbenzene SMILES: C#CC1=CC=C(C=C1)Br

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PubChem CID	136603
CAS	766-96-1
Molecular Weight (g/mol)	181.03
SMILES	C#CC1=CC=C(C=C1)Br
Synonym	4-bromophenylacetylene,benzene, 1-bromo-4-ethynyl,1-bromo-4-ethynyl-benzene,4-bromophenyl acetylene,4'-bromophenyl acetylene,4'-bromophenylacetylene,p-bromophenylacetylene,p-bromophenyl acetylene,4-bromphenyl acetylene,4-bromo-1-ethynylbenzene
IUPAC Name	1-bromo-4-ethynylbenzene
InChI Key	LTLVZQZDXQWLHU-UHFFFAOYSA-N
Molecular Formula	C₈H₅Br

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1-Bromo-2-ethylbenzene, 98%

CAS: 1973-22-4 Molecular Formula: C8H9Br Molecular Weight (g/mol): 185.064 MDL Number: MFCD00000077 InChI Key: HVRUGFJYCAFAAN-UHFFFAOYSA-N PubChem CID: 16089 IUPAC Name: 1-bromo-2-ethylbenzene SMILES: CCC1=CC=CC=C1Br

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PubChem CID	16089
CAS	1973-22-4
Molecular Weight (g/mol)	185.064
MDL Number	MFCD00000077
SMILES	CCC1=CC=CC=C1Br
IUPAC Name	1-bromo-2-ethylbenzene
InChI Key	HVRUGFJYCAFAAN-UHFFFAOYSA-N
Molecular Formula	C8H9Br

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3-Bromo-5-fluorobenzonitrile, 98%

CAS: 179898-34-1 Molecular Formula: C7H3BrFN Molecular Weight (g/mol): 200.01 MDL Number: MFCD04038227 InChI Key: IADLVSLZPQYXIF-UHFFFAOYSA-N Synonym: 3-fluoro-5-bromobenzonitrile,benzonitrile, 3-bromo-5-fluoro,5-bromo-3-fluorobenzenecarbonitrile,3-cyano-5-fluorobromobenzene,3-bromo 5-fluorobenzonitrile,3-bromo-5-fluoro-benzonitrile,3-bromo-5-fluorobenzenecarbonitrile,pubchem3220,acmc-209yem,3-fluoro-5-bromobenzonitile PubChem CID: 2783330 IUPAC Name: 3-bromo-5-fluorobenzonitrile SMILES: FC1=CC(Br)=CC(=C1)C#N

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PubChem CID	2783330
CAS	179898-34-1
Molecular Weight (g/mol)	200.01
MDL Number	MFCD04038227
SMILES	FC1=CC(Br)=CC(=C1)C#N
Synonym	3-fluoro-5-bromobenzonitrile,benzonitrile, 3-bromo-5-fluoro,5-bromo-3-fluorobenzenecarbonitrile,3-cyano-5-fluorobromobenzene,3-bromo 5-fluorobenzonitrile,3-bromo-5-fluoro-benzonitrile,3-bromo-5-fluorobenzenecarbonitrile,pubchem3220,acmc-209yem,3-fluoro-5-bromobenzonitile
IUPAC Name	3-bromo-5-fluorobenzonitrile
InChI Key	IADLVSLZPQYXIF-UHFFFAOYSA-N
Molecular Formula	C7H3BrFN

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1-Bromo-4-nitrobenzene, 98%

CAS: 586-78-7 Molecular Formula: C6H4BrNO2 Molecular Weight (g/mol): 202.01 MDL Number: MFCD00007280 InChI Key: ZDFBKZUDCQQKAC-UHFFFAOYSA-N Synonym: 4-bromonitrobenzene,4-nitrobromobenzene,p-bromonitrobenzene,benzene, 1-bromo-4-nitro,p-nitrobromobenzene,4-nitrophenyl bromide,4-bromo-1-nitrobenzene,p-nitrophenyl bromide,1-bromo-4-nitro-benzene,ccris 3115 PubChem CID: 11466 IUPAC Name: 1-bromo-4-nitrobenzene SMILES: [O-][N+](=O)C1=CC=C(Br)C=C1

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PubChem CID	11466
CAS	586-78-7
Molecular Weight (g/mol)	202.01
MDL Number	MFCD00007280
SMILES	[O-][N+](=O)C1=CC=C(Br)C=C1
Synonym	4-bromonitrobenzene,4-nitrobromobenzene,p-bromonitrobenzene,benzene, 1-bromo-4-nitro,p-nitrobromobenzene,4-nitrophenyl bromide,4-bromo-1-nitrobenzene,p-nitrophenyl bromide,1-bromo-4-nitro-benzene,ccris 3115
IUPAC Name	1-bromo-4-nitrobenzene
InChI Key	ZDFBKZUDCQQKAC-UHFFFAOYSA-N
Molecular Formula	C6H4BrNO2

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3-Bromo-5-fluoroaniline, 95%, Thermo Scientific Chemicals

CAS: 134168-97-1 Molecular Formula: C6H5BrFN Molecular Weight (g/mol): 190.02 MDL Number: MFCD07779529 InChI Key: NGZAVSDIXFIWHJ-UHFFFAOYSA-N Synonym: 3-fluoro-5-bromoaniline,5-amino-1-bromo-3-fluorobenzene,3-bromo-5-fluoro-phenylamine,benzenamine, 3-bromo-5-fluoro,5-bromo-3-fluoroaniline,acmc-1bbb3,ksc120c3j,3-bromo-5-fluorobenzenamine PubChem CID: 15020155 IUPAC Name: 3-bromo-5-fluoroaniline SMILES: NC1=CC(F)=CC(Br)=C1

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PubChem CID	15020155
CAS	134168-97-1
Molecular Weight (g/mol)	190.02
MDL Number	MFCD07779529
SMILES	NC1=CC(F)=CC(Br)=C1
Synonym	3-fluoro-5-bromoaniline,5-amino-1-bromo-3-fluorobenzene,3-bromo-5-fluoro-phenylamine,benzenamine, 3-bromo-5-fluoro,5-bromo-3-fluoroaniline,acmc-1bbb3,ksc120c3j,3-bromo-5-fluorobenzenamine
IUPAC Name	3-bromo-5-fluoroaniline
InChI Key	NGZAVSDIXFIWHJ-UHFFFAOYSA-N
Molecular Formula	C6H5BrFN

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4-Bromo-3-nitroaniline, 97%

CAS: 53324-38-2 Molecular Formula: C6H5BrN2O2 Molecular Weight (g/mol): 217.02 MDL Number: MFCD01320678 InChI Key: PITHQPMZWKZGRZ-UHFFFAOYSA-N Synonym: 4-bromo-3-nitro-phenylamine,benzenamine, 4-bromo-3-nitro,4-bromo-3-nitro-aniline,4-bromo-3-nitrophenylamine,pubchem2613,3-nitro-4-bromoaniline,4-bromo-3-nitrobenzenamine,4-bromanyl-3-nitro-aniline,ksc494a6p,benzenamine,4-bromo-3-nitro PubChem CID: 612299 IUPAC Name: 4-bromo-3-nitroaniline SMILES: NC1=CC=C(Br)C(=C1)[N+]([O-])=O

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PubChem CID	612299
CAS	53324-38-2
Molecular Weight (g/mol)	217.02
MDL Number	MFCD01320678
SMILES	NC1=CC=C(Br)C(=C1)[N+]([O-])=O
Synonym	4-bromo-3-nitro-phenylamine,benzenamine, 4-bromo-3-nitro,4-bromo-3-nitro-aniline,4-bromo-3-nitrophenylamine,pubchem2613,3-nitro-4-bromoaniline,4-bromo-3-nitrobenzenamine,4-bromanyl-3-nitro-aniline,ksc494a6p,benzenamine,4-bromo-3-nitro
IUPAC Name	4-bromo-3-nitroaniline
InChI Key	PITHQPMZWKZGRZ-UHFFFAOYSA-N
Molecular Formula	C6H5BrN2O2

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2-Bromo-1,3-dichlorobenzene, 97%

CAS: 19393-92-1 Molecular Formula: C6H3BrCl2 Molecular Weight (g/mol): 225.894 MDL Number: MFCD00000574 InChI Key: UWOIDOQAQPUVOH-UHFFFAOYSA-N Synonym: 1-bromo-2,6-dichlorobenzene,2,6-dichlorobromobenzene,1,3-dichloro-2-bromobenzene,benzene, 2-bromo-1,3-dichloro,2,6-dichloro-1-bromobenzene,benzene, 1-bromo-2,6-dichloro,pubchem3610,acmc-209exg,2,6-dichlorobromo benzene,2,6-dichlorophenyl bromide PubChem CID: 29568 IUPAC Name: 2-bromo-1,3-dichlorobenzene SMILES: C1=CC(=C(C(=C1)Cl)Br)Cl

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PubChem CID	29568
CAS	19393-92-1
Molecular Weight (g/mol)	225.894
MDL Number	MFCD00000574
SMILES	C1=CC(=C(C(=C1)Cl)Br)Cl
Synonym	1-bromo-2,6-dichlorobenzene,2,6-dichlorobromobenzene,1,3-dichloro-2-bromobenzene,benzene, 2-bromo-1,3-dichloro,2,6-dichloro-1-bromobenzene,benzene, 1-bromo-2,6-dichloro,pubchem3610,acmc-209exg,2,6-dichlorobromo benzene,2,6-dichlorophenyl bromide
IUPAC Name	2-bromo-1,3-dichlorobenzene
InChI Key	UWOIDOQAQPUVOH-UHFFFAOYSA-N
Molecular Formula	C6H3BrCl2

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Hexabromobenzene, 97%

CAS: 87-82-1 Molecular Formula: C6Br6 Molecular Weight (g/mol): 551.49 MDL Number: MFCD00000058 InChI Key: CAYGQBVSOZLICD-UHFFFAOYSA-N Synonym: hexabromobenzene,benzene, hexabromo,perbromobenzene,unii-t01859xwir,ccris 5917,benzene, 1,2,3,4,5,6-hexabromo,hxbbz,hexabioomobenzene,acmc-20aj0o PubChem CID: 6905 IUPAC Name: 1,2,3,4,5,6-hexabromobenzene SMILES: C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)Br

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PubChem CID	6905
CAS	87-82-1
Molecular Weight (g/mol)	551.49
MDL Number	MFCD00000058
SMILES	C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)Br
Synonym	hexabromobenzene,benzene, hexabromo,perbromobenzene,unii-t01859xwir,ccris 5917,benzene, 1,2,3,4,5,6-hexabromo,hxbbz,hexabioomobenzene,acmc-20aj0o
IUPAC Name	1,2,3,4,5,6-hexabromobenzene
InChI Key	CAYGQBVSOZLICD-UHFFFAOYSA-N
Molecular Formula	C6Br6

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1,2,4,5-Tetrabromobenzene, 97%

CAS: 636-28-2 Molecular Formula: C6H2Br4 Molecular Weight (g/mol): 393.70 MDL Number: MFCD00000063 InChI Key: QCKHVNQHBOGZER-UHFFFAOYSA-N PubChem CID: 12486 IUPAC Name: 1,2,4,5-tetrabromobenzene SMILES: BrC1=CC(Br)=C(Br)C=C1Br

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PubChem CID	12486
CAS	636-28-2
Molecular Weight (g/mol)	393.70
MDL Number	MFCD00000063
SMILES	BrC1=CC(Br)=C(Br)C=C1Br
IUPAC Name	1,2,4,5-tetrabromobenzene
InChI Key	QCKHVNQHBOGZER-UHFFFAOYSA-N
Molecular Formula	C6H2Br4

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2-Bromo-1,3-diethylbenzene, 94%

CAS: 65232-57-7 Molecular Formula: C10H13Br Molecular Weight (g/mol): 213.12 MDL Number: MFCD00017770 InChI Key: FPWGIABDOFXETH-UHFFFAOYSA-N Synonym: 2,6-diethylbromobenzene,1-bromo-2,6-diethylbenzene,2,6-diethyl bromobenzene,benzene, 2-bromo-1,3-diethyl,acmc-20ao3d,2,6-diethylphenylbromide,2,6-diethylphenyl bromide,1,3-diethyl-2-bromobenzene,2-bromo-1,3-diethyl-benzene,# PubChem CID: 522160 IUPAC Name: 2-bromo-1,3-diethylbenzene SMILES: CCC1=CC=CC(CC)=C1Br

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Specifications

PubChem CID	522160
CAS	65232-57-7
Molecular Weight (g/mol)	213.12
MDL Number	MFCD00017770
SMILES	CCC1=CC=CC(CC)=C1Br
Synonym	2,6-diethylbromobenzene,1-bromo-2,6-diethylbenzene,2,6-diethyl bromobenzene,benzene, 2-bromo-1,3-diethyl,acmc-20ao3d,2,6-diethylphenylbromide,2,6-diethylphenyl bromide,1,3-diethyl-2-bromobenzene,2-bromo-1,3-diethyl-benzene,#
IUPAC Name	2-bromo-1,3-diethylbenzene
InChI Key	FPWGIABDOFXETH-UHFFFAOYSA-N
Molecular Formula	C10H13Br

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