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Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.
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871 – 885 of 119,426 results
871

4-(tert-Butyl)phenyl isocyanate, 97%, Thermo Scientific™

CAS: 1943-67-5 Molecular Formula: C11H13NO Molecular Weight (g/mol): 175.231 MDL Number: MFCD00040718 InChI Key: WUWBDQJTQTVBSQ-UHFFFAOYSA-N Synonym: 4-tert-butylphenyl isocyanate,4-tert-butylphenylisocyanate,benzene, 1-1,1-dimethylethyl-4-isocyanato,4-tert-butylphenyl-isocyanate,4-tert-butyl phenyl isocyanate,1-tert-butyl-4-isocyanato-benzene,benzene,1-1,1-dimethylethyl-4-isocyanato,4-t-butylphenylisocyanate,acmc-209ey5,4-tertbutylphenyl isocyanate PubChem CID: 2735695 IUPAC Name: 1-tert-butyl-4-isocyanatobenzene SMILES: CC(C)(C)C1=CC=C(C=C1)N=C=O

PubChem CID 2735695
CAS 1943-67-5
Molecular Weight (g/mol) 175.231
MDL Number MFCD00040718
SMILES CC(C)(C)C1=CC=C(C=C1)N=C=O
Synonym 4-tert-butylphenyl isocyanate,4-tert-butylphenylisocyanate,benzene, 1-1,1-dimethylethyl-4-isocyanato,4-tert-butylphenyl-isocyanate,4-tert-butyl phenyl isocyanate,1-tert-butyl-4-isocyanato-benzene,benzene,1-1,1-dimethylethyl-4-isocyanato,4-t-butylphenylisocyanate,acmc-209ey5,4-tertbutylphenyl isocyanate
IUPAC Name 1-tert-butyl-4-isocyanatobenzene
InChI Key WUWBDQJTQTVBSQ-UHFFFAOYSA-N
Molecular Formula C11H13NO
872

2-[3,5-di(tert-butyl)-4-hydroxyphenyl]acetic acid, Thermo Scientific™

CAS: 1611-03-6 Molecular Formula: C16H24O3 Molecular Weight (g/mol): 264.365 InChI Key: QLMGIWHWWWXXME-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyl-4-hydroxyphenylacetic acid,3,5-di-tert-butyl-4-hydroxyphenyl acetic acid,2-3,5-di tert-butyl-4-hydroxyphenyl acetic acid,2-3,5-di-tert-butyl-4-hydroxyphenyl acetic acid,benzeneacetic acid,3,5-bis 1,1-dimethylethyl-4-hydroxy,acmc-1bvft,4-hydroxy-3,5-di-t-butylphenylacetic acid,3,5-di-t-butyl-4-hydroxyphenyl-acetic acid,4-hydroxy-3,5-di-t-butyl-phenylacetic acid,3,5-di-tert-butyl-4-hydroxybenzeneacetic acid PubChem CID: 2775110 IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)acetic acid SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(=O)O

PubChem CID 2775110
CAS 1611-03-6
Molecular Weight (g/mol) 264.365
SMILES CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(=O)O
Synonym 3,5-di-tert-butyl-4-hydroxyphenylacetic acid,3,5-di-tert-butyl-4-hydroxyphenyl acetic acid,2-3,5-di tert-butyl-4-hydroxyphenyl acetic acid,2-3,5-di-tert-butyl-4-hydroxyphenyl acetic acid,benzeneacetic acid,3,5-bis 1,1-dimethylethyl-4-hydroxy,acmc-1bvft,4-hydroxy-3,5-di-t-butylphenylacetic acid,3,5-di-t-butyl-4-hydroxyphenyl-acetic acid,4-hydroxy-3,5-di-t-butyl-phenylacetic acid,3,5-di-tert-butyl-4-hydroxybenzeneacetic acid
IUPAC Name 2-(3,5-ditert-butyl-4-hydroxyphenyl)acetic acid
InChI Key QLMGIWHWWWXXME-UHFFFAOYSA-N
Molecular Formula C16H24O3
873

3,5-Di(tert-butyl)-4-hydroxybenzonitrile, 97%, Thermo Scientific™

CAS: 1988-88-1 Molecular Formula: C15H21NO Molecular Weight (g/mol): 231.34 MDL Number: MFCD00156137 InChI Key: AKXIIOLURNATOC-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyl-4-hydroxybenzonitrile,3,5-di tert-butyl-4-hydroxybenzonitrile,benzonitrile, 3,5-bis 1,1-dimethylethyl-4-hydroxy,benzonitrile, 3,5-di-tert-butyl-4-hydroxy,4-cyano-2,6-di-tert-butylphenol,3,5-bis tert-butyl-4-hydroxybenzenecarbonitrile,acmc-20a6ry,2,6-bis tert-butyl-4-cyanophenol,3,5-di-t-butyl-4-hydroxybenzonitrile,4-hydroxy-3,5-di-t-butylbenzonitrile PubChem CID: 137274 SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C#N

PubChem CID 137274
CAS 1988-88-1
Molecular Weight (g/mol) 231.34
MDL Number MFCD00156137
SMILES CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C#N
Synonym 3,5-di-tert-butyl-4-hydroxybenzonitrile,3,5-di tert-butyl-4-hydroxybenzonitrile,benzonitrile, 3,5-bis 1,1-dimethylethyl-4-hydroxy,benzonitrile, 3,5-di-tert-butyl-4-hydroxy,4-cyano-2,6-di-tert-butylphenol,3,5-bis tert-butyl-4-hydroxybenzenecarbonitrile,acmc-20a6ry,2,6-bis tert-butyl-4-cyanophenol,3,5-di-t-butyl-4-hydroxybenzonitrile,4-hydroxy-3,5-di-t-butylbenzonitrile
InChI Key AKXIIOLURNATOC-UHFFFAOYSA-N
Molecular Formula C15H21NO
874

4-(tert-Butyl)-2-chloroaniline, 95%, Thermo Scientific™

CAS: 42265-67-8 Molecular Formula: C10H14ClN Molecular Weight (g/mol): 183.68 MDL Number: MFCD00052272 InChI Key: MFEZEFHCSBXPPO-UHFFFAOYSA-N Synonym: 4-tert-butyl-2-chloroaniline,4-t-butyl-2-chloroaniline,2-chloro-4-tert-butylaniline,4-tert-butyl-2-chloro-aniline,aniline, 4-tert-butyl-2-chloro,4-tert-butyl-2-chlorophenylamine,benzenamine,2-chloro-4-1,1-dimethylethyl PubChem CID: 521094 IUPAC Name: 4-tert-butyl-2-chloroaniline SMILES: CC(C)(C)C1=CC(Cl)=C(N)C=C1

PubChem CID 521094
CAS 42265-67-8
Molecular Weight (g/mol) 183.68
MDL Number MFCD00052272
SMILES CC(C)(C)C1=CC(Cl)=C(N)C=C1
Synonym 4-tert-butyl-2-chloroaniline,4-t-butyl-2-chloroaniline,2-chloro-4-tert-butylaniline,4-tert-butyl-2-chloro-aniline,aniline, 4-tert-butyl-2-chloro,4-tert-butyl-2-chlorophenylamine,benzenamine,2-chloro-4-1,1-dimethylethyl
IUPAC Name 4-tert-butyl-2-chloroaniline
InChI Key MFEZEFHCSBXPPO-UHFFFAOYSA-N
Molecular Formula C10H14ClN
875

[4-(tert-Butyl)phenyl]methanesulfonyl chloride, Tech., Thermo Scientific™

CAS: 519056-61-2 Molecular Formula: C11H15ClO2S Molecular Weight (g/mol): 246.749 MDL Number: MFCD04115413 InChI Key: NEJDUPGGBSPJLG-UHFFFAOYSA-N Synonym: 4-tert-butylphenyl methanesulfonyl chloride,4-tert-butyl phenyl methanesulfonyl chloride,4-tert-butyl phenyl methanesulfonylchloride,4-tert-butylphenyl methanesulphonyl chloride,4-1-butyl phenylmethanesulfonyl chloride,4-tert-butyl phenyl methyl chlorosulfone PubChem CID: 2794645 IUPAC Name: (4-tert-butylphenyl)methanesulfonyl chloride SMILES: CC(C)(C)C1=CC=C(C=C1)CS(=O)(=O)Cl

PubChem CID 2794645
CAS 519056-61-2
Molecular Weight (g/mol) 246.749
MDL Number MFCD04115413
SMILES CC(C)(C)C1=CC=C(C=C1)CS(=O)(=O)Cl
Synonym 4-tert-butylphenyl methanesulfonyl chloride,4-tert-butyl phenyl methanesulfonyl chloride,4-tert-butyl phenyl methanesulfonylchloride,4-tert-butylphenyl methanesulphonyl chloride,4-1-butyl phenylmethanesulfonyl chloride,4-tert-butyl phenyl methyl chlorosulfone
IUPAC Name (4-tert-butylphenyl)methanesulfonyl chloride
InChI Key NEJDUPGGBSPJLG-UHFFFAOYSA-N
Molecular Formula C11H15ClO2S
876
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4-Bromoaniline, 96%, pract.

CAS: 106-40-1 Molecular Formula: C6H6BrN Molecular Weight (g/mol): 172.02 MDL Number: MFCD00007822 InChI Key: WDFQBORIUYODSI-UHFFFAOYSA-N Synonym: p-bromoaniline,4-bromobenzenamine,benzenamine, 4-bromo,p-bromophenylamine,aniline, p-bromo,4-bromo-aniline,4-bromobenzeneamine,p-bromo aniline,4-bromanilinu,4-bromo-phenylamine PubChem CID: 7807 IUPAC Name: 4-bromoaniline SMILES: C1=CC(=CC=C1N)Br

PubChem CID 7807
CAS 106-40-1
Molecular Weight (g/mol) 172.02
MDL Number MFCD00007822
SMILES C1=CC(=CC=C1N)Br
Synonym p-bromoaniline,4-bromobenzenamine,benzenamine, 4-bromo,p-bromophenylamine,aniline, p-bromo,4-bromo-aniline,4-bromobenzeneamine,p-bromo aniline,4-bromanilinu,4-bromo-phenylamine
IUPAC Name 4-bromoaniline
InChI Key WDFQBORIUYODSI-UHFFFAOYSA-N
Molecular Formula C6H6BrN
877
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2-Bromo-1,3-dimethoxybenzene, 98%

CAS: 16932-45-9 Molecular Formula: C8H9BrO2 Molecular Weight (g/mol): 217.062 MDL Number: MFCD07780177 InChI Key: VHVYSMMZHORFKU-UHFFFAOYSA-N PubChem CID: 612296 IUPAC Name: 2-bromo-1,3-dimethoxybenzene SMILES: COC1=C(C(=CC=C1)OC)Br

PubChem CID 612296
CAS 16932-45-9
Molecular Weight (g/mol) 217.062
MDL Number MFCD07780177
SMILES COC1=C(C(=CC=C1)OC)Br
IUPAC Name 2-bromo-1,3-dimethoxybenzene
InChI Key VHVYSMMZHORFKU-UHFFFAOYSA-N
Molecular Formula C8H9BrO2
878
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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

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
879

4-(4-Bromophenyl)-1,2,3-thiadiazole, 97%, Thermo Scientific™

CAS: 40753-13-7 Molecular Formula: C8H5BrN2S Molecular Weight (g/mol): 241.106 MDL Number: MFCD00084907 InChI Key: HGWOTVRPRHVJQK-UHFFFAOYSA-N PubChem CID: 218520 IUPAC Name: 4-(4-bromophenyl)thiadiazole SMILES: C1=CC(=CC=C1C2=CSN=N2)Br

PubChem CID 218520
CAS 40753-13-7
Molecular Weight (g/mol) 241.106
MDL Number MFCD00084907
SMILES C1=CC(=CC=C1C2=CSN=N2)Br
IUPAC Name 4-(4-bromophenyl)thiadiazole
InChI Key HGWOTVRPRHVJQK-UHFFFAOYSA-N
Molecular Formula C8H5BrN2S
880
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1,2,4-Tribromobenzene, 95%

CAS: 615-54-3 Molecular Formula: C6H3Br3 Molecular Weight (g/mol): 314.802 MDL Number: MFCD00000062 InChI Key: FWAJPSIPOULHHH-UHFFFAOYSA-N PubChem CID: 12002 IUPAC Name: 1,2,4-tribromobenzene SMILES: C1=CC(=C(C=C1Br)Br)Br

PubChem CID 12002
CAS 615-54-3
Molecular Weight (g/mol) 314.802
MDL Number MFCD00000062
SMILES C1=CC(=C(C=C1Br)Br)Br
IUPAC Name 1,2,4-tribromobenzene
InChI Key FWAJPSIPOULHHH-UHFFFAOYSA-N
Molecular Formula C6H3Br3
881
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4-Bromobenzylzinc bromide, 0.5M in THF, packaged under Argon in resealable ChemSeal™ bottles

CAS: 115055-85-1 Molecular Formula: C7H6Br2Zn Molecular Weight (g/mol): 315.31 MDL Number: MFCD01311435 InChI Key: HJQDBIKHGQSYJU-UHFFFAOYSA-M Synonym: zinc 2+ ion 4-bromophenyl methanide bromide PubChem CID: 57346859 IUPAC Name: zinc(2+) (4-bromophenyl)methanide bromide SMILES: [Zn++].[Br-].[CH2-]C1=CC=C(Br)C=C1

PubChem CID 57346859
CAS 115055-85-1
Molecular Weight (g/mol) 315.31
MDL Number MFCD01311435
SMILES [Zn++].[Br-].[CH2-]C1=CC=C(Br)C=C1
Synonym zinc 2+ ion 4-bromophenyl methanide bromide
IUPAC Name zinc(2+) (4-bromophenyl)methanide bromide
InChI Key HJQDBIKHGQSYJU-UHFFFAOYSA-M
Molecular Formula C7H6Br2Zn
882
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4-Bromo-2-chloroaniline, 99%

CAS: 38762-41-3 Molecular Formula: C6H5BrClN Molecular Weight (g/mol): 206.47 MDL Number: MFCD00007660 InChI Key: INMZDDDQLHKGPF-UHFFFAOYSA-N Synonym: 2-chloro-4-bromoaniline,4-bromo-2-chloro-phenylamine,benzenamine, 4-bromo-2-chloro,4-bromo-2-chloro-aniline,4-bromo-2-chlorophenylamine,4-bromo-6-chloroaniline,4-bromo-2-chlorobenzenamine,zlchem 546,pubchem3578,2-chloro4-bromoaniline PubChem CID: 610169 IUPAC Name: 4-bromo-2-chloroaniline SMILES: C1=CC(=C(C=C1Br)Cl)N

PubChem CID 610169
CAS 38762-41-3
Molecular Weight (g/mol) 206.47
MDL Number MFCD00007660
SMILES C1=CC(=C(C=C1Br)Cl)N
Synonym 2-chloro-4-bromoaniline,4-bromo-2-chloro-phenylamine,benzenamine, 4-bromo-2-chloro,4-bromo-2-chloro-aniline,4-bromo-2-chlorophenylamine,4-bromo-6-chloroaniline,4-bromo-2-chlorobenzenamine,zlchem 546,pubchem3578,2-chloro4-bromoaniline
IUPAC Name 4-bromo-2-chloroaniline
InChI Key INMZDDDQLHKGPF-UHFFFAOYSA-N
Molecular Formula C6H5BrClN
883
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3,5-Dibromotoluene, 98+%

CAS: 1611-92-3 Molecular Formula: C7H6Br2 Molecular Weight (g/mol): 249.93 MDL Number: MFCD00013528 InChI Key: DPKKOVGCHDUSAI-UHFFFAOYSA-N Synonym: 3,5-dibromotoluene,benzene, 1,3-dibromo-5-methyl,toluene, 3,5-dibromo,3 ,5-dibromotoluene,1,3-dibromo-5-methyl-benzene,5-dibromotoluene,3,5-dibromo toluene,3,5-dibromo-toluene,pubchem3934,acmc-1bs6w PubChem CID: 15361 IUPAC Name: 1,3-dibromo-5-methylbenzene SMILES: CC1=CC(Br)=CC(Br)=C1

PubChem CID 15361
CAS 1611-92-3
Molecular Weight (g/mol) 249.93
MDL Number MFCD00013528
SMILES CC1=CC(Br)=CC(Br)=C1
Synonym 3,5-dibromotoluene,benzene, 1,3-dibromo-5-methyl,toluene, 3,5-dibromo,3 ,5-dibromotoluene,1,3-dibromo-5-methyl-benzene,5-dibromotoluene,3,5-dibromo toluene,3,5-dibromo-toluene,pubchem3934,acmc-1bs6w
IUPAC Name 1,3-dibromo-5-methylbenzene
InChI Key DPKKOVGCHDUSAI-UHFFFAOYSA-N
Molecular Formula C7H6Br2
884
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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

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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1-Bromo-3-ethylbenzene, 98%

CAS: 2725-82-8 Molecular Formula: C8H9Br Molecular Weight (g/mol): 185.064 MDL Number: MFCD00156128 InChI Key: ZRFJYAZQMFCUIX-UHFFFAOYSA-N Synonym: benzene, 1-bromo-3-ethyl,3-ethylbromobenzene,1-bromo-3-ethyl-benzene,3-bromoethyl benzene,3ethylbromobenzene,m-bromoethylbenzene,3-bromo-ethylbenzene,pubchem3771,1bromo-3-ethylbenzene,1-bromo-3-ethylbenze PubChem CID: 123170 IUPAC Name: 1-bromo-3-ethylbenzene SMILES: CCC1=CC(=CC=C1)Br

PubChem CID 123170
CAS 2725-82-8
Molecular Weight (g/mol) 185.064
MDL Number MFCD00156128
SMILES CCC1=CC(=CC=C1)Br
Synonym benzene, 1-bromo-3-ethyl,3-ethylbromobenzene,1-bromo-3-ethyl-benzene,3-bromoethyl benzene,3ethylbromobenzene,m-bromoethylbenzene,3-bromo-ethylbenzene,pubchem3771,1bromo-3-ethylbenzene,1-bromo-3-ethylbenze
IUPAC Name 1-bromo-3-ethylbenzene
InChI Key ZRFJYAZQMFCUIX-UHFFFAOYSA-N
Molecular Formula C8H9Br