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

6-Bromochromone-3-carboxylic acid, 97%

CAS: 51085-91-7 Molecular Formula: C10H5BrO4 Molecular Weight (g/mol): 269.05 MDL Number: MFCD01548933 InChI Key: IJTWNMVKNJSGMS-UHFFFAOYSA-N Synonym: 6-bromochromone-3-carboxylic acid,6-bromo-4-oxo-4h-chromene-3-carboxylic acid,6-bromochromon-3-carboxylic acid PubChem CID: 2756898 IUPAC Name: 6-bromo-4-oxochromene-3-carboxylic acid SMILES: C1=CC2=C(C=C1Br)C(=O)C(=CO2)C(=O)O

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PubChem CID	2756898
CAS	51085-91-7
Molecular Weight (g/mol)	269.05
MDL Number	MFCD01548933
SMILES	C1=CC2=C(C=C1Br)C(=O)C(=CO2)C(=O)O
Synonym	6-bromochromone-3-carboxylic acid,6-bromo-4-oxo-4h-chromene-3-carboxylic acid,6-bromochromon-3-carboxylic acid
IUPAC Name	6-bromo-4-oxochromene-3-carboxylic acid
InChI Key	IJTWNMVKNJSGMS-UHFFFAOYSA-N
Molecular Formula	C10H5BrO4

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

4-Bromo-3,5-dimethyl-1H-pyrazole, 98%

CAS: 3398-16-1 Molecular Formula: C5H7BrN2 Molecular Weight (g/mol): 175.029 MDL Number: MFCD00005242 InChI Key: RISOHYOEPYWKOB-UHFFFAOYSA-N Synonym: 4-bromo-3,5-dimethylpyrazole,pyrazole, 4-bromo-3,5-dimethyl,3,5-dimethyl-4-bromopyrazole,1h-pyrazole, 4-bromo-3,5-dimethyl,3.5-dimethyl-4-bromopyrazole,acmc-1cnce,5-23-05-00154 beilstein handbook reference,ksc495g9b,4-bromo-3,5-dimethyl pyrazole,4-bromo-3,5-dimethyl-pyrazole PubChem CID: 76937 IUPAC Name: 4-bromo-3,5-dimethyl-1H-pyrazole SMILES: CC1=C(C(=NN1)C)Br

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PubChem CID	76937
CAS	3398-16-1
Molecular Weight (g/mol)	175.029
MDL Number	MFCD00005242
SMILES	CC1=C(C(=NN1)C)Br
Synonym	4-bromo-3,5-dimethylpyrazole,pyrazole, 4-bromo-3,5-dimethyl,3,5-dimethyl-4-bromopyrazole,1h-pyrazole, 4-bromo-3,5-dimethyl,3.5-dimethyl-4-bromopyrazole,acmc-1cnce,5-23-05-00154 beilstein handbook reference,ksc495g9b,4-bromo-3,5-dimethyl pyrazole,4-bromo-3,5-dimethyl-pyrazole
IUPAC Name	4-bromo-3,5-dimethyl-1H-pyrazole
InChI Key	RISOHYOEPYWKOB-UHFFFAOYSA-N
Molecular Formula	C5H7BrN2

5-Bromo-2-chloropyrimidine, 96%, Thermo Scientific Chemicals

CAS: 32779-36-5 Molecular Formula: C4H2BrClN2 Molecular Weight (g/mol): 193.43 MDL Number: MFCD00483232 InChI Key: XPGIBDJXEVAVTO-UHFFFAOYSA-N Synonym: 2-chloro-5-bromopyrimidine,5-bromo-2-chloro-pyrimidine,5-bromo-2-chloropyrimidne,pyrimidine, 5-bromo-2-chloro,5-bromo-2-chloro-1,3-diazine,pubchem5159,zlchem 1210,acmc-209hvm,5-bromo chloropyrimidine,5-bromo-2-chloroprimidine PubChem CID: 606665 IUPAC Name: 5-bromo-2-chloropyrimidine SMILES: ClC1=NC=C(Br)C=N1

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PubChem CID	606665
CAS	32779-36-5
Molecular Weight (g/mol)	193.43
MDL Number	MFCD00483232
SMILES	ClC1=NC=C(Br)C=N1
Synonym	2-chloro-5-bromopyrimidine,5-bromo-2-chloro-pyrimidine,5-bromo-2-chloropyrimidne,pyrimidine, 5-bromo-2-chloro,5-bromo-2-chloro-1,3-diazine,pubchem5159,zlchem 1210,acmc-209hvm,5-bromo chloropyrimidine,5-bromo-2-chloroprimidine
IUPAC Name	5-bromo-2-chloropyrimidine
InChI Key	XPGIBDJXEVAVTO-UHFFFAOYSA-N
Molecular Formula	C4H2BrClN2

5-Bromo-8-methoxyquinoline, 96%

CAS: 10522-47-1 Molecular Formula: C10H8BrNO Molecular Weight (g/mol): 238.08 MDL Number: MFCD04966996 InChI Key: ZRQISUREPLHYIG-UHFFFAOYSA-N Synonym: quinoline, 5-bromo-8-methoxy PubChem CID: 4715023 IUPAC Name: 5-bromo-8-methoxyquinoline SMILES: COC1=C2N=CC=CC2=C(Br)C=C1

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PubChem CID	4715023
CAS	10522-47-1
Molecular Weight (g/mol)	238.08
MDL Number	MFCD04966996
SMILES	COC1=C2N=CC=CC2=C(Br)C=C1
Synonym	quinoline, 5-bromo-8-methoxy
IUPAC Name	5-bromo-8-methoxyquinoline
InChI Key	ZRQISUREPLHYIG-UHFFFAOYSA-N
Molecular Formula	C10H8BrNO

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

4-Bromothiazole, 97%

CAS: 34259-99-9 Molecular Formula: C3H2BrNS Molecular Weight (g/mol): 164.02 MDL Number: MFCD06657592 InChI Key: VDTIGYKLTROQAH-UHFFFAOYSA-N Synonym: 4-bromothiazole,4-bromo-thiazole,4-bromo thiazole,thiazole, 4-bromo,4-bromothiazol,zlchem 498,pubchem4040,ksc222g1h PubChem CID: 2763218 IUPAC Name: 4-bromo-1,3-thiazole SMILES: BrC1=CSC=N1

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PubChem CID	2763218
CAS	34259-99-9
Molecular Weight (g/mol)	164.02
MDL Number	MFCD06657592
SMILES	BrC1=CSC=N1
Synonym	4-bromothiazole,4-bromo-thiazole,4-bromo thiazole,thiazole, 4-bromo,4-bromothiazol,zlchem 498,pubchem4040,ksc222g1h
IUPAC Name	4-bromo-1,3-thiazole
InChI Key	VDTIGYKLTROQAH-UHFFFAOYSA-N
Molecular Formula	C3H2BrNS

6-Bromo-1,3-benzothiazole, 97%, Thermo Scientific™

CAS: 53218-26-1 Molecular Formula: C7H4BrNS Molecular Weight (g/mol): 214.08 MDL Number: MFCD04115372 InChI Key: YJOUISWKEOXIMC-UHFFFAOYSA-N Synonym: 6-bromobenzothiazole,6-bromobenzo d thiazole,benzothiazole, 6-bromo,6-bromo-benzothiazole,6-bromo-benzo d thiazole,pubchem21861,acmc-209l4t,6-bromanyl-1,3-benzothiazole,benzothiazole, 6-bromo-9ci PubChem CID: 2795171 IUPAC Name: 6-bromo-1,3-benzothiazole SMILES: C1=CC2=C(C=C1Br)SC=N2

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PubChem CID	2795171
CAS	53218-26-1
Molecular Weight (g/mol)	214.08
MDL Number	MFCD04115372
SMILES	C1=CC2=C(C=C1Br)SC=N2
Synonym	6-bromobenzothiazole,6-bromobenzo d thiazole,benzothiazole, 6-bromo,6-bromo-benzothiazole,6-bromo-benzo d thiazole,pubchem21861,acmc-209l4t,6-bromanyl-1,3-benzothiazole,benzothiazole, 6-bromo-9ci
IUPAC Name	6-bromo-1,3-benzothiazole
InChI Key	YJOUISWKEOXIMC-UHFFFAOYSA-N
Molecular Formula	C7H4BrNS

5-Bromo-3-(chloromethyl)-1-benzothiophene, ≥97%, Thermo Scientific™

CAS: 852180-53-1 Molecular Formula: C9H6BrClS Molecular Weight (g/mol): 261.561 MDL Number: MFCD07772810 InChI Key: ZIOALKCKGFEWMX-UHFFFAOYSA-N PubChem CID: 7164583 IUPAC Name: 5-bromo-3-(chloromethyl)-1-benzothiophene SMILES: C1=CC2=C(C=C1Br)C(=CS2)CCl

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Specifications

PubChem CID	7164583
CAS	852180-53-1
Molecular Weight (g/mol)	261.561
MDL Number	MFCD07772810
SMILES	C1=CC2=C(C=C1Br)C(=CS2)CCl
IUPAC Name	5-bromo-3-(chloromethyl)-1-benzothiophene
InChI Key	ZIOALKCKGFEWMX-UHFFFAOYSA-N
Molecular Formula	C9H6BrClS

6-Bromoquinoline-5-carbonitrile, 95%

CAS: 1188365-70-9 Molecular Formula: C10H5BrN2 Molecular Weight (g/mol): 233.068 MDL Number: MFCD22683072 InChI Key: DTWHKRFZYKUTHB-UHFFFAOYSA-N Synonym: 6-Bromo-5-cyanoquinoline PubChem CID: 70817991 IUPAC Name: 6-bromoquinoline-5-carbonitrile SMILES: C1=CC2=C(C=CC(=C2C#N)Br)N=C1

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Specifications

PubChem CID	70817991
CAS	1188365-70-9
Molecular Weight (g/mol)	233.068
MDL Number	MFCD22683072
SMILES	C1=CC2=C(C=CC(=C2C#N)Br)N=C1
Synonym	6-Bromo-5-cyanoquinoline
IUPAC Name	6-bromoquinoline-5-carbonitrile
InChI Key	DTWHKRFZYKUTHB-UHFFFAOYSA-N
Molecular Formula	C10H5BrN2

Aryl bromides

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