Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.

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3,406 – 3,420 of 159,106 results

3,406

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3,5-Dibromobenzeneboronic acid, 97%

CAS: 117695-55-3 Molecular Formula: C6H5BBr2O2 Molecular Weight (g/mol): 279.722 MDL Number: MFCD01075725 InChI Key: WQBLCGDZYFKINX-UHFFFAOYSA-N Synonym: 3,5-dibromobenzeneboronic acid,3,5-dibromophenyl boronic acid,boronic acid, 3,5-dibromophenyl,pubchem14108,acmc-2099ur,amtb596,3,5-dibromobenzeneboronicacid,ksc493i3d,3,5-dibromobenzene boronic acid PubChem CID: 2734689 IUPAC Name: (3,5-dibromophenyl)boronic acid SMILES: B(C1=CC(=CC(=C1)Br)Br)(O)O

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Specifications

PubChem CID	2734689
CAS	117695-55-3
Molecular Weight (g/mol)	279.722
MDL Number	MFCD01075725
SMILES	B(C1=CC(=CC(=C1)Br)Br)(O)O
Synonym	3,5-dibromobenzeneboronic acid,3,5-dibromophenyl boronic acid,boronic acid, 3,5-dibromophenyl,pubchem14108,acmc-2099ur,amtb596,3,5-dibromobenzeneboronicacid,ksc493i3d,3,5-dibromobenzene boronic acid
IUPAC Name	(3,5-dibromophenyl)boronic acid
InChI Key	WQBLCGDZYFKINX-UHFFFAOYSA-N
Molecular Formula	C6H5BBr2O2

3,407

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1-Bromo-2,3,5,6-tetramethylbenzene, 99%

CAS: 1646-53-3 Molecular Formula: C10H13Br Molecular Weight (g/mol): 213.118 MDL Number: MFCD00000070 InChI Key: WJKBPTLQJXKEHC-UHFFFAOYSA-N Synonym: bromodurene,3-bromodurene,1-bromo-2,3,5,6-tetramethylbenzene,benzene, 3-bromo-1,2,4,5-tetramethyl,bromdurol,duryl bromide,bromodurene, pract.,acmc-1bz04,2,3,5,6-tetramethylbromobenzene,1-bromo-2,5,6-tetramethylbenzene PubChem CID: 74240 IUPAC Name: 3-bromo-1,2,4,5-tetramethylbenzene SMILES: CC1=CC(=C(C(=C1C)Br)C)C

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PubChem CID	74240
CAS	1646-53-3
Molecular Weight (g/mol)	213.118
MDL Number	MFCD00000070
SMILES	CC1=CC(=C(C(=C1C)Br)C)C
Synonym	bromodurene,3-bromodurene,1-bromo-2,3,5,6-tetramethylbenzene,benzene, 3-bromo-1,2,4,5-tetramethyl,bromdurol,duryl bromide,bromodurene, pract.,acmc-1bz04,2,3,5,6-tetramethylbromobenzene,1-bromo-2,5,6-tetramethylbenzene
IUPAC Name	3-bromo-1,2,4,5-tetramethylbenzene
InChI Key	WJKBPTLQJXKEHC-UHFFFAOYSA-N
Molecular Formula	C10H13Br

3,408

1-(4-Bromophenyl)-3,5-dimethyl-1H-pyrazole, 97%, Thermo Scientific™

CAS: 62546-27-4 Molecular Formula: C11H11BrN2 Molecular Weight (g/mol): 251.127 MDL Number: MFCD09817558 InChI Key: ATCMNDCOEJOOSF-UHFFFAOYSA-N Synonym: 1-4-bromophenyl-3,5-dimethyl-1h-pyrazole,1-4-bromophenyl-3,5-dimethylpyrazole,1h-pyrazole, 1-4-bromophenyl-3,5-dimethyl,acmc-209n4v PubChem CID: 24229761 IUPAC Name: 1-(4-bromophenyl)-3,5-dimethylpyrazole SMILES: CC1=CC(=NN1C2=CC=C(C=C2)Br)C

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Specifications

PubChem CID	24229761
CAS	62546-27-4
Molecular Weight (g/mol)	251.127
MDL Number	MFCD09817558
SMILES	CC1=CC(=NN1C2=CC=C(C=C2)Br)C
Synonym	1-4-bromophenyl-3,5-dimethyl-1h-pyrazole,1-4-bromophenyl-3,5-dimethylpyrazole,1h-pyrazole, 1-4-bromophenyl-3,5-dimethyl,acmc-209n4v
IUPAC Name	1-(4-bromophenyl)-3,5-dimethylpyrazole
InChI Key	ATCMNDCOEJOOSF-UHFFFAOYSA-N
Molecular Formula	C11H11BrN2

3,409

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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

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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

3,410

5-Bromo-3-methyl-benzene-1,2-diamine, 97%, Thermo Scientific™

CAS: 76153-06-5 Molecular Formula: C7H9BrN2 Molecular Weight (g/mol): 201.067 InChI Key: UOFSLKHZOPVGHG-UHFFFAOYSA-N Synonym: 5-bromo-3-methyl-benzene-1,2-diamine,5-bromo-3-methyl-1,2-benzenediamine,1,2-benzenediamine, 5-bromo-3-methyl,2,3-diamino-5-bromotoluene,5-bromo-2,3-diaminotoluene,bromomethylbenzenediamine,pubchem22667,ksc642k2n,5-bromo-2,3-diamino-toluene,5-bromo-2.3-diamino-toluene PubChem CID: 1516397 IUPAC Name: 5-bromo-3-methylbenzene-1,2-diamine SMILES: CC1=CC(=CC(=C1N)N)Br

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Specifications

PubChem CID	1516397
CAS	76153-06-5
Molecular Weight (g/mol)	201.067
SMILES	CC1=CC(=CC(=C1N)N)Br
Synonym	5-bromo-3-methyl-benzene-1,2-diamine,5-bromo-3-methyl-1,2-benzenediamine,1,2-benzenediamine, 5-bromo-3-methyl,2,3-diamino-5-bromotoluene,5-bromo-2,3-diaminotoluene,bromomethylbenzenediamine,pubchem22667,ksc642k2n,5-bromo-2,3-diamino-toluene,5-bromo-2.3-diamino-toluene
IUPAC Name	5-bromo-3-methylbenzene-1,2-diamine
InChI Key	UOFSLKHZOPVGHG-UHFFFAOYSA-N
Molecular Formula	C7H9BrN2

3,411

2-(4-Bromobenzyl)thiophene, 97%, Thermo Scientific™

CAS: 118150-25-7 Molecular Formula: C11H9BrS Molecular Weight (g/mol): 253.157 MDL Number: MFCD11841076 InChI Key: GGYCIKURJBHUER-UHFFFAOYSA-N Synonym: 2-4-bromobenzyl thiophene,2-4-bromophenyl methyl thiophene PubChem CID: 15322628 IUPAC Name: 2-[(4-bromophenyl)methyl]thiophene SMILES: C1=CSC(=C1)CC2=CC=C(C=C2)Br

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Specifications

PubChem CID	15322628
CAS	118150-25-7
Molecular Weight (g/mol)	253.157
MDL Number	MFCD11841076
SMILES	C1=CSC(=C1)CC2=CC=C(C=C2)Br
Synonym	2-4-bromobenzyl thiophene,2-4-bromophenyl methyl thiophene
IUPAC Name	2-[(4-bromophenyl)methyl]thiophene
InChI Key	GGYCIKURJBHUER-UHFFFAOYSA-N
Molecular Formula	C11H9BrS

3,412

3-(3-Bromophenyl)-1H-pyrazole, ≥97%, Thermo Scientific™

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

3,413

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4-Benzyloxy-1-bromo-2-fluorobenzene, 98%

CAS: 185346-79-6 Molecular Formula: C13H10BrFO Molecular Weight (g/mol): 281.124 MDL Number: MFCD09801041 InChI Key: BYTJTXKQBSNGCL-UHFFFAOYSA-N Synonym: 4-benzyloxy-1-bromo-2-fluorobenzene,4-benzyloxy-2-fluorobromobenzene,benzene,1-bromo-2-fluoro-4-phenylmethoxy,acmc-1c1vq,benzyloxy-4-bromo-3-fluorobenzene,1-benzyloxy-4-bromo-3-fluorobenzene,benzyl 4-bromo-3-fluorophenyl ether,1-bromo-2-fluoro-4-benzyloxy benzene PubChem CID: 22273933 IUPAC Name: 1-bromo-2-fluoro-4-phenylmethoxybenzene SMILES: C1=CC=C(C=C1)COC2=CC(=C(C=C2)Br)F

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Specifications

PubChem CID	22273933
CAS	185346-79-6
Molecular Weight (g/mol)	281.124
MDL Number	MFCD09801041
SMILES	C1=CC=C(C=C1)COC2=CC(=C(C=C2)Br)F
Synonym	4-benzyloxy-1-bromo-2-fluorobenzene,4-benzyloxy-2-fluorobromobenzene,benzene,1-bromo-2-fluoro-4-phenylmethoxy,acmc-1c1vq,benzyloxy-4-bromo-3-fluorobenzene,1-benzyloxy-4-bromo-3-fluorobenzene,benzyl 4-bromo-3-fluorophenyl ether,1-bromo-2-fluoro-4-benzyloxy benzene
IUPAC Name	1-bromo-2-fluoro-4-phenylmethoxybenzene
InChI Key	BYTJTXKQBSNGCL-UHFFFAOYSA-N
Molecular Formula	C13H10BrFO

3,414

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2-(2-Bromophenyl)-1,3-dioxolane, 98%

CAS: 34824-58-3 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00155124 InChI Key: IWSGKSUCFVOWQU-UHFFFAOYSA-N Synonym: 2-2-bromophenyl-1,3-dioxolane,2-bromobenzaldehyde ethylene acetal,1,3-dioxolane, 2-2-bromophenyl,1-bromo-2-1,3-dioxolan-2-yl benzene,2-bromophenyldioxolane,2-bromo benzaldehyde ethylene glycol acetal,2-2-bromo-phenyl-1,3 dioxolane,pubchem3729,acmc-1csyy,bromobenzaldehyde ethylene acetal PubChem CID: 553534 IUPAC Name: 2-(2-bromophenyl)-1,3-dioxolane SMILES: BrC1=CC=CC=C1C1OCCO1

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Specifications

PubChem CID	553534
CAS	34824-58-3
Molecular Weight (g/mol)	229.07
MDL Number	MFCD00155124
SMILES	BrC1=CC=CC=C1C1OCCO1
Synonym	2-2-bromophenyl-1,3-dioxolane,2-bromobenzaldehyde ethylene acetal,1,3-dioxolane, 2-2-bromophenyl,1-bromo-2-1,3-dioxolan-2-yl benzene,2-bromophenyldioxolane,2-bromo benzaldehyde ethylene glycol acetal,2-2-bromo-phenyl-1,3 dioxolane,pubchem3729,acmc-1csyy,bromobenzaldehyde ethylene acetal
IUPAC Name	2-(2-bromophenyl)-1,3-dioxolane
InChI Key	IWSGKSUCFVOWQU-UHFFFAOYSA-N
Molecular Formula	C9H9BrO2

3,415

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1-Bromo-3-n-hexylbenzene, 97+%

CAS: 38409-59-5 Molecular Formula: C12H17Br Molecular Weight (g/mol): 241.172 MDL Number: MFCD09909567 InChI Key: HZUVRCRPECDFAT-UHFFFAOYSA-N Synonym: 1-bromo-3-n-hexylbenzene,1-bromo-3-hexyl-benzene,3-hexylbromobenzene,3-n-hexyl bromobenzene,#,benzene, 1-bromo-3-hexyl PubChem CID: 563022 IUPAC Name: 1-bromo-3-hexylbenzene SMILES: CCCCCCC1=CC(=CC=C1)Br

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Specifications

PubChem CID	563022
CAS	38409-59-5
Molecular Weight (g/mol)	241.172
MDL Number	MFCD09909567
SMILES	CCCCCCC1=CC(=CC=C1)Br
Synonym	1-bromo-3-n-hexylbenzene,1-bromo-3-hexyl-benzene,3-hexylbromobenzene,3-n-hexyl bromobenzene,#,benzene, 1-bromo-3-hexyl
IUPAC Name	1-bromo-3-hexylbenzene
InChI Key	HZUVRCRPECDFAT-UHFFFAOYSA-N
Molecular Formula	C12H17Br

3,416

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1-Bromo-4-(n-octyloxy)benzene, 98%

CAS: 96693-05-9 Molecular Formula: C14H21BrO Molecular Weight (g/mol): 285.225 MDL Number: MFCD00043445 InChI Key: UVBFFPZGOOKWNR-UHFFFAOYSA-N Synonym: p-bromophenyl octyl ether,1-bromo-4-octyloxy benzene,1-bromo-4-octyloxybenzene,4-n-octyloxybromobenzene,1-bromo-4-n-octyloxy benzene,4-bromo-1-octyloxybenzene,4-octyloxybromobenzene,4-bromo-octyloxybenzene,4-bromophenyloctyl ether,1-4-bromophenoxy octane PubChem CID: 145298 IUPAC Name: 1-bromo-4-octoxybenzene SMILES: CCCCCCCCOC1=CC=C(C=C1)Br

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PubChem CID	145298
CAS	96693-05-9
Molecular Weight (g/mol)	285.225
MDL Number	MFCD00043445
SMILES	CCCCCCCCOC1=CC=C(C=C1)Br
Synonym	p-bromophenyl octyl ether,1-bromo-4-octyloxy benzene,1-bromo-4-octyloxybenzene,4-n-octyloxybromobenzene,1-bromo-4-n-octyloxy benzene,4-bromo-1-octyloxybenzene,4-octyloxybromobenzene,4-bromo-octyloxybenzene,4-bromophenyloctyl ether,1-4-bromophenoxy octane
IUPAC Name	1-bromo-4-octoxybenzene
InChI Key	UVBFFPZGOOKWNR-UHFFFAOYSA-N
Molecular Formula	C14H21BrO

3,417

1-(4-Bromophenoxy)hexane, 97%, Thermo Scientific™

CAS: 30752-19-3 Molecular Formula: C12H17BrO Molecular Weight (g/mol): 257.171 InChI Key: GKLMJONYGGTHHM-UHFFFAOYSA-N Synonym: 1-bromo-4-hexyloxy benzene,1-bromo-4-hexyloxybenzene,1-4-bromophenoxy hexane,1-bromo-4-n-hexyloxybenzene,4-n-hexyloxybromobenzene,p-bromophenylhexyl ether,benzene, 1-bromo-4-hexyloxy,p-hexyloxybromobenzene,4-hexyloxybromobenzene,4-bromophenyl hexyl ether PubChem CID: 520492 IUPAC Name: 1-bromo-4-hexoxybenzene SMILES: CCCCCCOC1=CC=C(C=C1)Br

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Specifications

PubChem CID	520492
CAS	30752-19-3
Molecular Weight (g/mol)	257.171
SMILES	CCCCCCOC1=CC=C(C=C1)Br
Synonym	1-bromo-4-hexyloxy benzene,1-bromo-4-hexyloxybenzene,1-4-bromophenoxy hexane,1-bromo-4-n-hexyloxybenzene,4-n-hexyloxybromobenzene,p-bromophenylhexyl ether,benzene, 1-bromo-4-hexyloxy,p-hexyloxybromobenzene,4-hexyloxybromobenzene,4-bromophenyl hexyl ether
IUPAC Name	1-bromo-4-hexoxybenzene
InChI Key	GKLMJONYGGTHHM-UHFFFAOYSA-N
Molecular Formula	C12H17BrO

3,418

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2-Bromo-5-fluorobenzonitrile, 98+%

CAS: 57381-39-2 Molecular Formula: C7H3BrFN Molecular Weight (g/mol): 200.01 MDL Number: MFCD00142875 InChI Key: MDHNVHCZDCSTMS-UHFFFAOYSA-N Synonym: 2-bromo-5-fluorobenzenecarbonitrile,2-bromo-5-fluoro-benzonitrile,benzonitrile, 2-bromo-5-fluoro,2-cyano-4-fluorobromobenzene,pubchem3218,bromofluorobenzonitrile2,acmc-1awgr,brc6h3 f cn,ksc496i7h,2-bromo-5-fluorobenzonitrile PubChem CID: 93654 IUPAC Name: 2-bromo-5-fluorobenzonitrile SMILES: FC1=CC=C(Br)C(=C1)C#N

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Specifications

PubChem CID	93654
CAS	57381-39-2
Molecular Weight (g/mol)	200.01
MDL Number	MFCD00142875
SMILES	FC1=CC=C(Br)C(=C1)C#N
Synonym	2-bromo-5-fluorobenzenecarbonitrile,2-bromo-5-fluoro-benzonitrile,benzonitrile, 2-bromo-5-fluoro,2-cyano-4-fluorobromobenzene,pubchem3218,bromofluorobenzonitrile2,acmc-1awgr,brc6h3 f cn,ksc496i7h,2-bromo-5-fluorobenzonitrile
IUPAC Name	2-bromo-5-fluorobenzonitrile
InChI Key	MDHNVHCZDCSTMS-UHFFFAOYSA-N
Molecular Formula	C7H3BrFN

3,419

3-(4-Bromophenyl)-5-methyl-1,2,4-oxadiazole, 97%, Thermo Scientific™

CAS: 118183-92-9 Molecular Formula: C9H7BrN2O Molecular Weight (g/mol): 239.072 MDL Number: MFCD00487341 InChI Key: YWBIOYGLRGIJRT-UHFFFAOYSA-N PubChem CID: 823560 IUPAC Name: 3-(4-bromophenyl)-5-methyl-1,2,4-oxadiazole SMILES: CC1=NC(=NO1)C2=CC=C(C=C2)Br

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Specifications

PubChem CID	823560
CAS	118183-92-9
Molecular Weight (g/mol)	239.072
MDL Number	MFCD00487341
SMILES	CC1=NC(=NO1)C2=CC=C(C=C2)Br
IUPAC Name	3-(4-bromophenyl)-5-methyl-1,2,4-oxadiazole
InChI Key	YWBIOYGLRGIJRT-UHFFFAOYSA-N
Molecular Formula	C9H7BrN2O

3,420

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4-Bromo-2-methylphenyl isothiocyanate, 98%

CAS: 19241-38-4 Molecular Formula: C8H6BrNS Molecular Weight (g/mol): 228.107 MDL Number: MFCD00041087 InChI Key: YASXCQRGYJGIKD-UHFFFAOYSA-N Synonym: 4-bromo-2-methylphenyl isothiocyanate,4-bromo-1-isothiocyanato-o-toluene,4-bromo-2-methylphenylisothiocyanate,4-bromo-2-methyl-phenyl isothiocyanate,benzene, 4-bromo-1-isothiocyanato-2-methyl,acmc-1bu0e,#,benzene,4-bromo-1-isothiocyanato-2-methyl PubChem CID: 87977 IUPAC Name: 4-bromo-1-isothiocyanato-2-methylbenzene SMILES: CC1=C(C=CC(=C1)Br)N=C=S

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Specifications

PubChem CID	87977
CAS	19241-38-4
Molecular Weight (g/mol)	228.107
MDL Number	MFCD00041087
SMILES	CC1=C(C=CC(=C1)Br)N=C=S
Synonym	4-bromo-2-methylphenyl isothiocyanate,4-bromo-1-isothiocyanato-o-toluene,4-bromo-2-methylphenylisothiocyanate,4-bromo-2-methyl-phenyl isothiocyanate,benzene, 4-bromo-1-isothiocyanato-2-methyl,acmc-1bu0e,#,benzene,4-bromo-1-isothiocyanato-2-methyl
IUPAC Name	4-bromo-1-isothiocyanato-2-methylbenzene
InChI Key	YASXCQRGYJGIKD-UHFFFAOYSA-N
Molecular Formula	C8H6BrNS

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