Aryl bromides

Organic compounds that contain an aromatic ring with one or more hydrogen atoms replaced by a bromide ion; widely used as fire-retardants.

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1-Bromonaphthalene, 96%

CAS: 90-11-9 Molecular Weight (g/mol): 207.07 MDL Number: MFCD00003868 InChI Key: DLKQHBOKULLWDQ-UHFFFAOYSA-N Synonym: naphthalene, 1-bromo,1-naphthyl bromide,alpha-bromonaphthalene,bromonaphthalene,alpha-naphthyl bromide,.alpha.-bromonaphthalene,1-bromo-naphthalene,.alpha.-naphthyl bromide,naphthalene, bromo,bromonapthalene PubChem CID: 7001 IUPAC Name: 1-bromonaphthalene SMILES: C1=CC=C2C(=C1)C=CC=C2Br

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PubChem CID	7001
CAS	90-11-9
Molecular Weight (g/mol)	207.07
MDL Number	MFCD00003868
SMILES	C1=CC=C2C(=C1)C=CC=C2Br
Synonym	naphthalene, 1-bromo,1-naphthyl bromide,alpha-bromonaphthalene,bromonaphthalene,alpha-naphthyl bromide,.alpha.-bromonaphthalene,1-bromo-naphthalene,.alpha.-naphthyl bromide,naphthalene, bromo,bromonapthalene
IUPAC Name	1-bromonaphthalene
InChI Key	DLKQHBOKULLWDQ-UHFFFAOYSA-N

2-Bromopyrimidine, 97+%

CAS: 4595-60-2 Molecular Formula: C4H3BrN2 Molecular Weight (g/mol): 158.99 MDL Number: MFCD00014601 InChI Key: PGFIHORVILKHIA-UHFFFAOYSA-N Synonym: pyrimidine, 2-bromo,2-brompyrimidin,bromopyrimidine,2-bromo pyrimidine,2-bromo-pyrimidine,2-bromanylpyrimidine,pubchem6901,acmc-1aqvo,2-bromo-1,3-diazine,2-bromopyrimidine PubChem CID: 78345 IUPAC Name: 2-bromopyrimidine SMILES: BrC1=NC=CC=N1

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PubChem CID	78345
CAS	4595-60-2
Molecular Weight (g/mol)	158.99
MDL Number	MFCD00014601
SMILES	BrC1=NC=CC=N1
Synonym	pyrimidine, 2-bromo,2-brompyrimidin,bromopyrimidine,2-bromo pyrimidine,2-bromo-pyrimidine,2-bromanylpyrimidine,pubchem6901,acmc-1aqvo,2-bromo-1,3-diazine,2-bromopyrimidine
IUPAC Name	2-bromopyrimidine
InChI Key	PGFIHORVILKHIA-UHFFFAOYSA-N
Molecular Formula	C4H3BrN2

3-Bromo-4-isocyanatothiophene, 95%, Thermo Scientific™

CAS: 937795-88-5 Molecular Formula: C5H2BrNOS Molecular Weight (g/mol): 204.041 MDL Number: MFCD09879904 InChI Key: HVJDEHSHJHNENX-UHFFFAOYSA-N Synonym: 4-bromothiophen-3-isocyanate,4-bromothien-3-yl isocyanate PubChem CID: 24229539 IUPAC Name: 3-bromo-4-isocyanatothiophene SMILES: C1=C(C(=CS1)Br)N=C=O

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PubChem CID	24229539
CAS	937795-88-5
Molecular Weight (g/mol)	204.041
MDL Number	MFCD09879904
SMILES	C1=C(C(=CS1)Br)N=C=O
Synonym	4-bromothiophen-3-isocyanate,4-bromothien-3-yl isocyanate
IUPAC Name	3-bromo-4-isocyanatothiophene
InChI Key	HVJDEHSHJHNENX-UHFFFAOYSA-N
Molecular Formula	C5H2BrNOS

5-Bromophthalide, 98%

CAS: 64169-34-2 Molecular Formula: C8H5BrO2 Molecular Weight (g/mol): 213.03 MDL Number: MFCD01797360 InChI Key: IUSPXLCLQIZFHL-UHFFFAOYSA-N Synonym: 5-bromophthalide,5-bromoisobenzofuran-1 3h-one,5-bromo-1 3h-isobenzofuranone,5-bromo-3h-isobenzofuran-1-one,1 3h-isobenzofuranone, 5-bromo,5-bromo-2-benzofuran-1 3h-one,5-bromo-3-hydroisobenzofuran-1-one,5-bromo-1,3-dihydro-2-benzofuran-1-one,5-bromo-1,3-dihydro-isobenzofuran-1-one,5-bromphthalide PubChem CID: 603144 IUPAC Name: 5-bromo-1,3-dihydro-2-benzofuran-1-one SMILES: BrC1=CC=C2C(=O)OCC2=C1

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PubChem CID	603144
CAS	64169-34-2
Molecular Weight (g/mol)	213.03
MDL Number	MFCD01797360
SMILES	BrC1=CC=C2C(=O)OCC2=C1
Synonym	5-bromophthalide,5-bromoisobenzofuran-1 3h-one,5-bromo-1 3h-isobenzofuranone,5-bromo-3h-isobenzofuran-1-one,1 3h-isobenzofuranone, 5-bromo,5-bromo-2-benzofuran-1 3h-one,5-bromo-3-hydroisobenzofuran-1-one,5-bromo-1,3-dihydro-2-benzofuran-1-one,5-bromo-1,3-dihydro-isobenzofuran-1-one,5-bromphthalide
IUPAC Name	5-bromo-1,3-dihydro-2-benzofuran-1-one
InChI Key	IUSPXLCLQIZFHL-UHFFFAOYSA-N
Molecular Formula	C8H5BrO2

4-Bromo-3-(trifluoromethyl)-1H-pyrazole, 97%, Thermo Scientific™

CAS: 19968-17-3 Molecular Formula: C₄H₂BrF₃N₂ Molecular Weight (g/mol): 214.97 InChI Key: JTHNMRUVJDWVMJ-UHFFFAOYSA-N Synonym: 4-bromo-3-trifluoromethyl-1h-pyrazole,4-bromo-5-trifluoromethyl-1h-pyrazole,1h-pyrazole, 4-bromo-3-trifluoromethyl,1h-pyrazole, 4-bromo-5-trifluoromethyl,1h-pyrazole,4-bromo-3-trifluoromethyl,4-bromo-3-trifluoromethyl pyrazole,4-bromo-3-trifluoromethyl-2h-pyrazole,acmc-209f4m,4-bromo-3 trifluoromethyl-1h-pyrazole PubChem CID: 7147398 IUPAC Name: 4-bromo-5-(trifluoromethyl)-1H-pyrazole SMILES: C1=NNC(=C1Br)C(F)(F)F

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PubChem CID	7147398
CAS	19968-17-3
Molecular Weight (g/mol)	214.97
SMILES	C1=NNC(=C1Br)C(F)(F)F
Synonym	4-bromo-3-trifluoromethyl-1h-pyrazole,4-bromo-5-trifluoromethyl-1h-pyrazole,1h-pyrazole, 4-bromo-3-trifluoromethyl,1h-pyrazole, 4-bromo-5-trifluoromethyl,1h-pyrazole,4-bromo-3-trifluoromethyl,4-bromo-3-trifluoromethyl pyrazole,4-bromo-3-trifluoromethyl-2h-pyrazole,acmc-209f4m,4-bromo-3 trifluoromethyl-1h-pyrazole
IUPAC Name	4-bromo-5-(trifluoromethyl)-1H-pyrazole
InChI Key	JTHNMRUVJDWVMJ-UHFFFAOYSA-N
Molecular Formula	C₄H₂BrF₃N₂

1-Bromonaphthalene, 97%

CAS: 90-11-9 Molecular Formula: C10H7Br Molecular Weight (g/mol): 207.07 MDL Number: MFCD00003868 InChI Key: DLKQHBOKULLWDQ-UHFFFAOYSA-N Synonym: naphthalene, 1-bromo,1-naphthyl bromide,alpha-bromonaphthalene,bromonaphthalene,alpha-naphthyl bromide,.alpha.-bromonaphthalene,1-bromo-naphthalene,.alpha.-naphthyl bromide,naphthalene, bromo,bromonapthalene PubChem CID: 7001 IUPAC Name: 1-bromonaphthalene SMILES: C1=CC=C2C(=C1)C=CC=C2Br

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PubChem CID	7001
CAS	90-11-9
Molecular Weight (g/mol)	207.07
MDL Number	MFCD00003868
SMILES	C1=CC=C2C(=C1)C=CC=C2Br
Synonym	naphthalene, 1-bromo,1-naphthyl bromide,alpha-bromonaphthalene,bromonaphthalene,alpha-naphthyl bromide,.alpha.-bromonaphthalene,1-bromo-naphthalene,.alpha.-naphthyl bromide,naphthalene, bromo,bromonapthalene
IUPAC Name	1-bromonaphthalene
InChI Key	DLKQHBOKULLWDQ-UHFFFAOYSA-N
Molecular Formula	C10H7Br

5-Bromobenzo[b]thiophene, 98+%

CAS: 4923-87-9 Molecular Formula: C8H5BrS Molecular Weight (g/mol): 213.09 MDL Number: MFCD03069318 InChI Key: RDSIMGKJEYNNLF-UHFFFAOYSA-N Synonym: 5-bromobenzo b thiophene,5-bromobenzothiophene,5-bromo-benzo b thiophene,5-bromothianaphthene,benzo b thiophene, 5-bromo,zlchem 181,pubchem7752,5-bromo-benzothiophene,pubchem15353,acmc-1anox PubChem CID: 2776578 IUPAC Name: 5-bromo-1-benzothiophene SMILES: BrC1=CC=C2SC=CC2=C1

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PubChem CID	2776578
CAS	4923-87-9
Molecular Weight (g/mol)	213.09
MDL Number	MFCD03069318
SMILES	BrC1=CC=C2SC=CC2=C1
Synonym	5-bromobenzo b thiophene,5-bromobenzothiophene,5-bromo-benzo b thiophene,5-bromothianaphthene,benzo b thiophene, 5-bromo,zlchem 181,pubchem7752,5-bromo-benzothiophene,pubchem15353,acmc-1anox
IUPAC Name	5-bromo-1-benzothiophene
InChI Key	RDSIMGKJEYNNLF-UHFFFAOYSA-N
Molecular Formula	C8H5BrS

5-Bromoindole-2-carboxylic acid, 98%

CAS: 7254-19-5 Molecular Formula: C₉H₆BrNO₂ Molecular Weight (g/mol): 240.05 MDL Number: MFCD00022705 InChI Key: YAULOOYNCJDPPU-UHFFFAOYSA-N Synonym: 5-bromoindole-2-carboxylic acid,5-bromo-2-indolecarboxylic acid,1h-indolecarboxylic acid, 5-bromo,1h-indole-2-carboxylic acid, 5-bromo,pubchem1663,zlchem 1343,acmc-1bb5x,chembl22435,5-bromo indole carboxylic acid,5-bromanyl-1h-indole-2-carboxylic acid PubChem CID: 252137 IUPAC Name: 5-bromo-1H-indole-2-carboxylic acid SMILES: C1=CC2=C(C=C1Br)C=C(N2)C(=O)O

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PubChem CID	252137
CAS	7254-19-5
Molecular Weight (g/mol)	240.05
MDL Number	MFCD00022705
SMILES	C1=CC2=C(C=C1Br)C=C(N2)C(=O)O
Synonym	5-bromoindole-2-carboxylic acid,5-bromo-2-indolecarboxylic acid,1h-indolecarboxylic acid, 5-bromo,1h-indole-2-carboxylic acid, 5-bromo,pubchem1663,zlchem 1343,acmc-1bb5x,chembl22435,5-bromo indole carboxylic acid,5-bromanyl-1h-indole-2-carboxylic acid
IUPAC Name	5-bromo-1H-indole-2-carboxylic acid
InChI Key	YAULOOYNCJDPPU-UHFFFAOYSA-N
Molecular Formula	C₉H₆BrNO₂

6-Bromo-2-chlorobenzothiazole, 97%

CAS: 80945-86-4 Molecular Formula: C7H3BrClNS Molecular Weight (g/mol): 248.522 MDL Number: MFCD04971822 InChI Key: IJQSMNIZBBEBKI-UHFFFAOYSA-N PubChem CID: 2049871 IUPAC Name: 6-bromo-2-chloro-1,3-benzothiazole SMILES: C1=CC2=C(C=C1Br)SC(=N2)Cl

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PubChem CID	2049871
CAS	80945-86-4
Molecular Weight (g/mol)	248.522
MDL Number	MFCD04971822
SMILES	C1=CC2=C(C=C1Br)SC(=N2)Cl
IUPAC Name	6-bromo-2-chloro-1,3-benzothiazole
InChI Key	IJQSMNIZBBEBKI-UHFFFAOYSA-N
Molecular Formula	C7H3BrClNS

ethyle4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylate, 97%, Thermo Scientific™

CAS: 5408-07-1 Molecular Formula: C9H12BrNO2 Molecular Weight (g/mol): 246.10 MDL Number: MFCD02647051 InChI Key: POLBZQUAKJYNIF-UHFFFAOYSA-N Synonym: 1h-pyrrole-2-carboxylic acid, 4-bromo-3,5-dimethyl-, ethyl ester,4-bromo-3,5-dimethyl-1h-pyrrole-2-carboxylic acid ethyl ester,ethyl 4-bromo-3,5-dimethylpyrrole-2-carboxylate,4-bromo-3,5-dimethyl-2-ethoxycarbonyl-1h-pyrrole,ethyl 4-bromo-3,5-dimethyl-1h-pyrrole-2-carboxylat,pyrrole-2-carboxylic acid, 4-bromo-3,5-dimethyl-, ethyl ester,1h-pyrrole-2-carboxylic acid, 4-bromo-3,5-dimethyl,ethyl ester PubChem CID: 138486 IUPAC Name: ethyl 4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylate SMILES: CCOC(=O)C1=C(C(=C(N1)C)Br)C

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PubChem CID	138486
CAS	5408-07-1
Molecular Weight (g/mol)	246.10
MDL Number	MFCD02647051
SMILES	CCOC(=O)C1=C(C(=C(N1)C)Br)C
Synonym	1h-pyrrole-2-carboxylic acid, 4-bromo-3,5-dimethyl-, ethyl ester,4-bromo-3,5-dimethyl-1h-pyrrole-2-carboxylic acid ethyl ester,ethyl 4-bromo-3,5-dimethylpyrrole-2-carboxylate,4-bromo-3,5-dimethyl-2-ethoxycarbonyl-1h-pyrrole,ethyl 4-bromo-3,5-dimethyl-1h-pyrrole-2-carboxylat,pyrrole-2-carboxylic acid, 4-bromo-3,5-dimethyl-, ethyl ester,1h-pyrrole-2-carboxylic acid, 4-bromo-3,5-dimethyl,ethyl ester
IUPAC Name	ethyl 4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylate
InChI Key	POLBZQUAKJYNIF-UHFFFAOYSA-N
Molecular Formula	C9H12BrNO2

4-Bromopyrazole, 98%

CAS: 2075-45-8 Molecular Formula: C3H3BrN2 Molecular Weight (g/mol): 146.98 MDL Number: MFCD00075602 InChI Key: WVGCPEDBFHEHEZ-UHFFFAOYSA-N PubChem CID: 16375 IUPAC Name: 4-bromo-1H-pyrazole SMILES: BrC1=CNN=C1

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PubChem CID	16375
CAS	2075-45-8
Molecular Weight (g/mol)	146.98
MDL Number	MFCD00075602
SMILES	BrC1=CNN=C1
IUPAC Name	4-bromo-1H-pyrazole
InChI Key	WVGCPEDBFHEHEZ-UHFFFAOYSA-N
Molecular Formula	C3H3BrN2

6-Bromoindole, 96%

CAS: 52415-29-9 Molecular Formula: C₈H₆BrN Molecular Weight (g/mol): 196.05 MDL Number: MFCD00238550 InChI Key: MAWGHOPSCKCTPA-UHFFFAOYSA-N Synonym: 6-bromoindole,1h-indole, 6-bromo,bromoindole-6,6-bromo-indole,6-brom-1h-indole,pubchem1662,6-bromo-1-h-indole,6-bromindol,maybridge1_006369 PubChem CID: 676493 IUPAC Name: 6-bromo-1H-indole SMILES: C1=CC(=CC2=C1C=CN2)Br

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PubChem CID	676493
CAS	52415-29-9
Molecular Weight (g/mol)	196.05
MDL Number	MFCD00238550
SMILES	C1=CC(=CC2=C1C=CN2)Br
Synonym	6-bromoindole,1h-indole, 6-bromo,bromoindole-6,6-bromo-indole,6-brom-1h-indole,pubchem1662,6-bromo-1-h-indole,6-bromindol,maybridge1_006369
IUPAC Name	6-bromo-1H-indole
InChI Key	MAWGHOPSCKCTPA-UHFFFAOYSA-N
Molecular Formula	C₈H₆BrN

2-bromo-5-(trifluoromethyl)-1,3,4-thiadiazole, Thermo Scientific™

CAS: 37461-61-3 Molecular Formula: C3BrF3N2S Molecular Weight (g/mol): 233.01 MDL Number: MFCD00015535 InChI Key: LGTVLLPQCMJOGT-UHFFFAOYSA-N PubChem CID: 12874685 IUPAC Name: 2-bromo-5-(trifluoromethyl)-1,3,4-thiadiazole SMILES: FC(F)(F)C1=NN=C(Br)S1

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PubChem CID	12874685
CAS	37461-61-3
Molecular Weight (g/mol)	233.01
MDL Number	MFCD00015535
SMILES	FC(F)(F)C1=NN=C(Br)S1
IUPAC Name	2-bromo-5-(trifluoromethyl)-1,3,4-thiadiazole
InChI Key	LGTVLLPQCMJOGT-UHFFFAOYSA-N
Molecular Formula	C3BrF3N2S

5-Bromo-1-benzofuran, 97%, Thermo Scientific™

CAS: 23145-07-5 Molecular Formula: C8H5BrO Molecular Weight (g/mol): 197.031 MDL Number: MFCD03407317 InChI Key: AYOVPQORFBWFNO-UHFFFAOYSA-N Synonym: 5-bromobenzofuran,benzofuran, 5-bromo,5-bromobenzo b furan,5-bromo-benzofuran,5-bromobenzo beta furan,buttpark 95\50-66,pubchem22017,5-bromobenzo b-furan,# PubChem CID: 90015 IUPAC Name: 5-bromo-1-benzofuran SMILES: C1=CC2=C(C=CO2)C=C1Br

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PubChem CID	90015
CAS	23145-07-5
Molecular Weight (g/mol)	197.031
MDL Number	MFCD03407317
SMILES	C1=CC2=C(C=CO2)C=C1Br
Synonym	5-bromobenzofuran,benzofuran, 5-bromo,5-bromobenzo b furan,5-bromo-benzofuran,5-bromobenzo beta furan,buttpark 95\50-66,pubchem22017,5-bromobenzo b-furan,#
IUPAC Name	5-bromo-1-benzofuran
InChI Key	AYOVPQORFBWFNO-UHFFFAOYSA-N
Molecular Formula	C8H5BrO

4-Bromo-1-methyl-1H-pyrazole-3-carbonitrile, 97%, Thermo Scientific Chemicals

CAS: 287922-71-8 Molecular Formula: C5H4BrN3 Molecular Weight (g/mol): 186.01 MDL Number: MFCD00103545 InChI Key: NTTLCOOFUGHMJS-UHFFFAOYSA-N Synonym: 4-bromo-1-methyl-1h-pyrazole-3-carbonitrile,1h-pyrazole-3-carbonitrile, 4-bromo-1-methyl,4-bromo-1-methyl-pyrazole-3-carbonitrile PubChem CID: 45594322 IUPAC Name: 4-bromo-1-methylpyrazole-3-carbonitrile SMILES: CN1C=C(Br)C(=N1)C#N

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Specifications

PubChem CID	45594322
CAS	287922-71-8
Molecular Weight (g/mol)	186.01
MDL Number	MFCD00103545
SMILES	CN1C=C(Br)C(=N1)C#N
Synonym	4-bromo-1-methyl-1h-pyrazole-3-carbonitrile,1h-pyrazole-3-carbonitrile, 4-bromo-1-methyl,4-bromo-1-methyl-pyrazole-3-carbonitrile
IUPAC Name	4-bromo-1-methylpyrazole-3-carbonitrile
InChI Key	NTTLCOOFUGHMJS-UHFFFAOYSA-N
Molecular Formula	C5H4BrN3

Aryl bromides

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