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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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3,841 – 3,855 of 43,828 results
3,841

4-Methoxy-alpha-toluenethiol, 95%, Thermo Scientific Chemicals

CAS: 6258-60-2 Molecular Formula: C8H10OS Molecular Weight (g/mol): 154.23 MDL Number: MFCD00004871 InChI Key: PTDVPWWJRCOIIO-UHFFFAOYSA-N Synonym: 4-methoxybenzyl mercaptan,4-methoxy-alpha-toluenethiol,4-methoxybenzylmercaptan,4-methoxyphenyl methanethiol,4-methoxy benzylmercaptan,4-methoxybenzenemethanethiol,benzenemethanethiol, 4-methoxy,p-methoxybenzyl mercaptan,p-methoxybenzylthiol,p-methoxybenzylmercaptan PubChem CID: 80407 IUPAC Name: (4-methoxyphenyl)methanethiol SMILES: COC1=CC=C(CS)C=C1

PubChem CID 80407
CAS 6258-60-2
Molecular Weight (g/mol) 154.23
MDL Number MFCD00004871
SMILES COC1=CC=C(CS)C=C1
Synonym 4-methoxybenzyl mercaptan,4-methoxy-alpha-toluenethiol,4-methoxybenzylmercaptan,4-methoxyphenyl methanethiol,4-methoxy benzylmercaptan,4-methoxybenzenemethanethiol,benzenemethanethiol, 4-methoxy,p-methoxybenzyl mercaptan,p-methoxybenzylthiol,p-methoxybenzylmercaptan
IUPAC Name (4-methoxyphenyl)methanethiol
InChI Key PTDVPWWJRCOIIO-UHFFFAOYSA-N
Molecular Formula C8H10OS
3,842

Thermo Scientific Chemicals Nitroterephthalic acid, 99+%

CAS: 610-29-7 Molecular Formula: C8H5NO6 Molecular Weight (g/mol): 211.13 MDL Number: MFCD00007141 InChI Key: QUMITRDILMWWBC-UHFFFAOYSA-N Synonym: nitroterephthalic acid,2-nitroterephthalic acid,2-nitrobenzene-1,4-dicarboxylic acid,1,4-benzenedicarboxylic acid, 2-nitro,terephthalic acid, nitro,2-nitroterephthalicacid,2-nitroterephthalate,5-nitroterephthalic acid,acmc-1au2u PubChem CID: 69122 SMILES: C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])C(=O)O

PubChem CID 69122
CAS 610-29-7
Molecular Weight (g/mol) 211.13
MDL Number MFCD00007141
SMILES C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])C(=O)O
Synonym nitroterephthalic acid,2-nitroterephthalic acid,2-nitrobenzene-1,4-dicarboxylic acid,1,4-benzenedicarboxylic acid, 2-nitro,terephthalic acid, nitro,2-nitroterephthalicacid,2-nitroterephthalate,5-nitroterephthalic acid,acmc-1au2u
InChI Key QUMITRDILMWWBC-UHFFFAOYSA-N
Molecular Formula C8H5NO6
3,843

Thermo Scientific Chemicals p-Tolylhydrazine hydrochloride, 98%

CAS: 637-60-5 Molecular Formula: C7H10N2·HCl Molecular Weight (g/mol): 158.63 MDL Number: MFCD00012940 InChI Key: HMHWNJGOHUYVMD-UHFFFAOYSA-N Synonym: p-tolylhydrazine hydrochloride,4-methylphenylhydrazine hydrochloride,4-methylphenyl hydrazine hydrochloride,4-tolylhydrazine hydrochloride,hydrazine, 4-methylphenyl-, monohydrochloride,p-tolylhydrazinium 1+ chloride,hydrazine, p-tolyl-, hydrochloride,4-methylphenylhydrazine hcl,1-4-methylphenyl hydrazine hydrochloride,p-tolyl-hydrazine hydrochloride PubChem CID: 12504 IUPAC Name: (4-methylphenyl)hydrazine;hydrochloride SMILES: CC1=CC=C(C=C1)NN.Cl

PubChem CID 12504
CAS 637-60-5
Molecular Weight (g/mol) 158.63
MDL Number MFCD00012940
SMILES CC1=CC=C(C=C1)NN.Cl
Synonym p-tolylhydrazine hydrochloride,4-methylphenylhydrazine hydrochloride,4-methylphenyl hydrazine hydrochloride,4-tolylhydrazine hydrochloride,hydrazine, 4-methylphenyl-, monohydrochloride,p-tolylhydrazinium 1+ chloride,hydrazine, p-tolyl-, hydrochloride,4-methylphenylhydrazine hcl,1-4-methylphenyl hydrazine hydrochloride,p-tolyl-hydrazine hydrochloride
IUPAC Name (4-methylphenyl)hydrazine;hydrochloride
InChI Key HMHWNJGOHUYVMD-UHFFFAOYSA-N
Molecular Formula C7H10N2·HCl
3,844

Thermo Scientific Chemicals Tris(triphenylphosphine)ruthenium(II) chloride, 98%

CAS: 15529-49-4 Molecular Formula: C54H45Cl2P3Ru Molecular Weight (g/mol): 958.85 MDL Number: MFCD00013077 InChI Key: KSHWMFNJCNGTJO-UHFFFAOYSA-L Synonym: dichlorotris triphenylphosphine ruthenium ii,tris triphenylphosphine ruthenium ii chloride,dichlorotris triphenylphosphino ruthenium ii,tris triphenylphosphine ruthenium ii dichloride,dichlorotris triphenylphosphine ruthenium,ruthenium ii-tris triphenylphosphine dichloride,tris triphenylphosphine dichlororuthenium,ruthenium dichlorotris triphenylphosphine,pubchem12822 PubChem CID: 11007548 IUPAC Name: dichlororuthenium;triphenylphosphane SMILES: [Cl-].[Cl-].[Ru+].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 11007548
CAS 15529-49-4
Molecular Weight (g/mol) 958.85
MDL Number MFCD00013077
SMILES [Cl-].[Cl-].[Ru+].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
Synonym dichlorotris triphenylphosphine ruthenium ii,tris triphenylphosphine ruthenium ii chloride,dichlorotris triphenylphosphino ruthenium ii,tris triphenylphosphine ruthenium ii dichloride,dichlorotris triphenylphosphine ruthenium,ruthenium ii-tris triphenylphosphine dichloride,tris triphenylphosphine dichlororuthenium,ruthenium dichlorotris triphenylphosphine,pubchem12822
IUPAC Name dichlororuthenium;triphenylphosphane
InChI Key KSHWMFNJCNGTJO-UHFFFAOYSA-L
Molecular Formula C54H45Cl2P3Ru
3,845

Thermo Scientific Chemicals 4-Vinylbenzyl acetate, 95%, stabilized

CAS: 1592-12-7 Molecular Formula: C11H12O2 Molecular Weight (g/mol): 176.22 MDL Number: MFCD00078265 InChI Key: LEIKPUSDAWATBV-UHFFFAOYSA-N Synonym: 4-vinylbenzyl acetate,4-ethenylphenyl methyl acetate,4-acetoxymethylstyrene,4-vinylbenzylacetate,p-acetoxymethylstyrene,4-vinylphenyl methyl acetate,4-ethenylbenzenemethanol acetate,benzenemethanol,4-ethenyl-, 1-acetate PubChem CID: 2735161 IUPAC Name: (4-ethenylphenyl)methyl acetate SMILES: CC(=O)OCC1=CC=C(C=C)C=C1

PubChem CID 2735161
CAS 1592-12-7
Molecular Weight (g/mol) 176.22
MDL Number MFCD00078265
SMILES CC(=O)OCC1=CC=C(C=C)C=C1
Synonym 4-vinylbenzyl acetate,4-ethenylphenyl methyl acetate,4-acetoxymethylstyrene,4-vinylbenzylacetate,p-acetoxymethylstyrene,4-vinylphenyl methyl acetate,4-ethenylbenzenemethanol acetate,benzenemethanol,4-ethenyl-, 1-acetate
IUPAC Name (4-ethenylphenyl)methyl acetate
InChI Key LEIKPUSDAWATBV-UHFFFAOYSA-N
Molecular Formula C11H12O2
3,846

5-Bromo-2-fluorobenzoic acid, 97%, Thermo Scientific Chemicals

CAS: 146328-85-0 Molecular Formula: C7H4BrFO2 Molecular Weight (g/mol): 219 MDL Number: MFCD00143423 InChI Key: PEXAZYDITWXYNJ-UHFFFAOYSA-N Synonym: 2-fluoro-5-bromobenzoic acid,5-bromo-2-fluoro-benzoic acid,buttpark 19\01-67,benzoic acid, 5-bromo-2-fluoro,3-bromo-6-fluoro-benzoic acid,pubchem1312,acmc-209cww,3-bromo-6-fluorobenzoic acid,ksc183q6j,rarechem al bo 0757 PubChem CID: 2736315 IUPAC Name: 5-bromo-2-fluorobenzoic acid SMILES: C1=CC(=C(C=C1Br)C(=O)O)F

PubChem CID 2736315
CAS 146328-85-0
Molecular Weight (g/mol) 219
MDL Number MFCD00143423
SMILES C1=CC(=C(C=C1Br)C(=O)O)F
Synonym 2-fluoro-5-bromobenzoic acid,5-bromo-2-fluoro-benzoic acid,buttpark 19\01-67,benzoic acid, 5-bromo-2-fluoro,3-bromo-6-fluoro-benzoic acid,pubchem1312,acmc-209cww,3-bromo-6-fluorobenzoic acid,ksc183q6j,rarechem al bo 0757
IUPAC Name 5-bromo-2-fluorobenzoic acid
InChI Key PEXAZYDITWXYNJ-UHFFFAOYSA-N
Molecular Formula C7H4BrFO2
3,847

Thermo Scientific Chemicals 4-tert-Butylbenzaldehyde, 95%

CAS: 939-97-9 Molecular Formula: C11H14O Molecular Weight (g/mol): 162.23 MDL Number: MFCD00035742 InChI Key: OTXINXDGSUFPNU-UHFFFAOYSA-N Synonym: 4-tert-butyl benzaldehyde,p-t-butylbenzaldehyde,p-tertbutyl benzaldehyde,benzaldehyde, 4-1,1-dimethylethyl,p-tert-butylbenzaldehyde,4-t-butylbenzaldehyde,4-tert-butyl-benzaldehyde,unii-qxf0qy8503,4-t-butyl benzaldehyde,benzaldehyde, p-tert-butyl PubChem CID: 70324 IUPAC Name: 4-tert-butylbenzaldehyde SMILES: CC(C)(C)C1=CC=C(C=O)C=C1

PubChem CID 70324
CAS 939-97-9
Molecular Weight (g/mol) 162.23
MDL Number MFCD00035742
SMILES CC(C)(C)C1=CC=C(C=O)C=C1
Synonym 4-tert-butyl benzaldehyde,p-t-butylbenzaldehyde,p-tertbutyl benzaldehyde,benzaldehyde, 4-1,1-dimethylethyl,p-tert-butylbenzaldehyde,4-t-butylbenzaldehyde,4-tert-butyl-benzaldehyde,unii-qxf0qy8503,4-t-butyl benzaldehyde,benzaldehyde, p-tert-butyl
IUPAC Name 4-tert-butylbenzaldehyde
InChI Key OTXINXDGSUFPNU-UHFFFAOYSA-N
Molecular Formula C11H14O
3,848

Thermo Scientific Chemicals 3-Methoxyphenethyl alcohol, 97%

CAS: 5020-41-7 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00002893 InChI Key: UPPGEJSCUZMCMW-UHFFFAOYSA-N Synonym: 2-3-methoxyphenyl ethanol,3-methoxyphenethyl alcohol,benzeneethanol, 3-methoxy,2-3-methoxyphenyl ethan-1-ol,phenethyl alcohol, m-methoxy,3-methoxybenzeneethanol,m-methoxyphenethyl alcohol,1-2-hydroxyethyl-3-methoxybenzene,acmc-20abd2,3-methoxyphenethylalcohol PubChem CID: 78724 IUPAC Name: 2-(3-methoxyphenyl)ethanol SMILES: COC1=CC=CC(=C1)CCO

PubChem CID 78724
CAS 5020-41-7
Molecular Weight (g/mol) 152.19
MDL Number MFCD00002893
SMILES COC1=CC=CC(=C1)CCO
Synonym 2-3-methoxyphenyl ethanol,3-methoxyphenethyl alcohol,benzeneethanol, 3-methoxy,2-3-methoxyphenyl ethan-1-ol,phenethyl alcohol, m-methoxy,3-methoxybenzeneethanol,m-methoxyphenethyl alcohol,1-2-hydroxyethyl-3-methoxybenzene,acmc-20abd2,3-methoxyphenethylalcohol
IUPAC Name 2-(3-methoxyphenyl)ethanol
InChI Key UPPGEJSCUZMCMW-UHFFFAOYSA-N
Molecular Formula C9H12O2
3,849

Thermo Scientific Chemicals 3-Methoxy-2-nitrobenzaldehyde, 97%

CAS: 53055-05-3 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.15 MDL Number: MFCD00007135 InChI Key: GDTUACILWWLIJF-UHFFFAOYSA-N PubChem CID: 98867 IUPAC Name: 3-methoxy-2-nitrobenzaldehyde SMILES: COC1=CC=CC(C=O)=C1[N+]([O-])=O

PubChem CID 98867
CAS 53055-05-3
Molecular Weight (g/mol) 181.15
MDL Number MFCD00007135
SMILES COC1=CC=CC(C=O)=C1[N+]([O-])=O
IUPAC Name 3-methoxy-2-nitrobenzaldehyde
InChI Key GDTUACILWWLIJF-UHFFFAOYSA-N
Molecular Formula C8H7NO4
3,850

Thermo Scientific Chemicals 3-(Benzyldimethylammonio)propanesulfonate, 95%

CAS: 81239-45-4 Molecular Formula: C12H19NO3S Molecular Weight (g/mol): 257.35 MDL Number: MFCD00225018 InChI Key: MEJASPJNLSQOAG-UHFFFAOYSA-N Synonym: ndsb-256,3-benzyl dimethyl ammonio propane-1-sulfonate,3-benzyldimethylammonio propane-1-sulfonate,dimethylbenzylammonium propane sulfonate,3-benzyl dimethyl ammonio propane-1-sulphonate,ndsb 256,dmx,3-benzyldimethylammonio propanesulfonate,3-dimethylbenzylamino propanesulfonic acid,3-benzyl dimethyl azaniumyl propane-1-sulfonate PubChem CID: 4386830 IUPAC Name: 3-[benzyl(dimethyl)azaniumyl]propane-1-sulfonate SMILES: C[N+](C)(CCCS([O-])(=O)=O)CC1=CC=CC=C1

PubChem CID 4386830
CAS 81239-45-4
Molecular Weight (g/mol) 257.35
MDL Number MFCD00225018
SMILES C[N+](C)(CCCS([O-])(=O)=O)CC1=CC=CC=C1
Synonym ndsb-256,3-benzyl dimethyl ammonio propane-1-sulfonate,3-benzyldimethylammonio propane-1-sulfonate,dimethylbenzylammonium propane sulfonate,3-benzyl dimethyl ammonio propane-1-sulphonate,ndsb 256,dmx,3-benzyldimethylammonio propanesulfonate,3-dimethylbenzylamino propanesulfonic acid,3-benzyl dimethyl azaniumyl propane-1-sulfonate
IUPAC Name 3-[benzyl(dimethyl)azaniumyl]propane-1-sulfonate
InChI Key MEJASPJNLSQOAG-UHFFFAOYSA-N
Molecular Formula C12H19NO3S
3,851

Thermo Scientific Chemicals 4-Fluoro-2-(trifluoromethyl)phenylboronic acid, 97%

CAS: 182344-16-7 Molecular Formula: C7H5BF4O2 Molecular Weight (g/mol): 207.92 MDL Number: MFCD08062379 InChI Key: SWUPLEAGZOKLNX-UHFFFAOYSA-N Synonym: 4-fluoro-2-trifluoromethyl phenyl boronic acid,4-fluoro-2-trifluoromethyl benzeneboronic acid,4-fluoro-2-trifluoromethyl phenylboronic acid,2-borono-5-fluorobenzotrifluoride,boronic acid, 4-fluoro-2-trifluoromethyl phenyl,akos brn-1027,acmc-1byq0,4-fluoro-2-trifluoromethyl-phenylboronic acid,ksc495e5n PubChem CID: 12109469 IUPAC Name: [4-fluoro-2-(trifluoromethyl)phenyl]boronic acid SMILES: OB(O)C1=C(C=C(F)C=C1)C(F)(F)F

PubChem CID 12109469
CAS 182344-16-7
Molecular Weight (g/mol) 207.92
MDL Number MFCD08062379
SMILES OB(O)C1=C(C=C(F)C=C1)C(F)(F)F
Synonym 4-fluoro-2-trifluoromethyl phenyl boronic acid,4-fluoro-2-trifluoromethyl benzeneboronic acid,4-fluoro-2-trifluoromethyl phenylboronic acid,2-borono-5-fluorobenzotrifluoride,boronic acid, 4-fluoro-2-trifluoromethyl phenyl,akos brn-1027,acmc-1byq0,4-fluoro-2-trifluoromethyl-phenylboronic acid,ksc495e5n
IUPAC Name [4-fluoro-2-(trifluoromethyl)phenyl]boronic acid
InChI Key SWUPLEAGZOKLNX-UHFFFAOYSA-N
Molecular Formula C7H5BF4O2
3,852

Thermo Scientific Chemicals 4-Hydroxybenzylamine hydrate, 97%

CAS: 696-60-6 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.16 MDL Number: MFCD19690971 InChI Key: RQJDUEKERVZLLU-UHFFFAOYSA-N Synonym: 4-hydroxybenzylamine,4-aminomethyl phenol,4-aminomethyl-phenol,para-hydroxybenzylamine,unii-7j7f85b7bi,4-hydroxyphenyl methanaminium bromide,a-amino-p-cresol,4-hyroxybenzylamine,p-hydroxybenzylamine,4-hydroxylbenzylamine PubChem CID: 97472 IUPAC Name: 4-(aminomethyl)phenol SMILES: NCC1=CC=C(O)C=C1

PubChem CID 97472
CAS 696-60-6
Molecular Weight (g/mol) 123.16
MDL Number MFCD19690971
SMILES NCC1=CC=C(O)C=C1
Synonym 4-hydroxybenzylamine,4-aminomethyl phenol,4-aminomethyl-phenol,para-hydroxybenzylamine,unii-7j7f85b7bi,4-hydroxyphenyl methanaminium bromide,a-amino-p-cresol,4-hyroxybenzylamine,p-hydroxybenzylamine,4-hydroxylbenzylamine
IUPAC Name 4-(aminomethyl)phenol
InChI Key RQJDUEKERVZLLU-UHFFFAOYSA-N
Molecular Formula C7H9NO
3,853

1-Benzyl-3-pyrroline, 97%, Thermo Scientific Chemicals

CAS: 6913-92-4 Molecular Formula: C11H13N Molecular Weight (g/mol): 159.23 InChI Key: LRFHKHHUKGZIGE-UHFFFAOYSA-N Synonym: 1-benzyl-3-pyrroline,1-benzyl-2,5-dihydro-1h-pyrrole,n-benzylpyrroline,n-benzyl-3-pyrroline,1h-pyrrole, 2,5-dihydro-1-phenylmethyl,maleimide-related compound 16,l-benzyl-3-pyrroline,n-benzyl 3-pyrroline,1-benzylpyrroline PubChem CID: 561506 IUPAC Name: 1-benzyl-2,5-dihydropyrrole SMILES: C1C=CCN1CC2=CC=CC=C2

PubChem CID 561506
CAS 6913-92-4
Molecular Weight (g/mol) 159.23
SMILES C1C=CCN1CC2=CC=CC=C2
Synonym 1-benzyl-3-pyrroline,1-benzyl-2,5-dihydro-1h-pyrrole,n-benzylpyrroline,n-benzyl-3-pyrroline,1h-pyrrole, 2,5-dihydro-1-phenylmethyl,maleimide-related compound 16,l-benzyl-3-pyrroline,n-benzyl 3-pyrroline,1-benzylpyrroline
IUPAC Name 1-benzyl-2,5-dihydropyrrole
InChI Key LRFHKHHUKGZIGE-UHFFFAOYSA-N
Molecular Formula C11H13N
3,854

Thermo Scientific Chemicals 2-Bromobenzaldehyde, 97%

CAS: 6630-33-7 Molecular Formula: C7H5BrO Molecular Weight (g/mol): 185.02 MDL Number: MFCD00003300 InChI Key: NDOPHXWIAZIXPR-UHFFFAOYSA-N Synonym: o-bromobenzaldehyde,benzaldehyde, 2-bromo,benzaldehyde, o-bromo,2-bromo benzaldehyde,bromobenzaldehyde,bromo benzaldehyde,o-bromo-benzaldehyde,2-formylbromobenzene,2-bromo-benzaldehyde,benzaldehyde, bromo PubChem CID: 81129 IUPAC Name: 2-bromobenzaldehyde SMILES: BrC1=CC=CC=C1C=O

PubChem CID 81129
CAS 6630-33-7
Molecular Weight (g/mol) 185.02
MDL Number MFCD00003300
SMILES BrC1=CC=CC=C1C=O
Synonym o-bromobenzaldehyde,benzaldehyde, 2-bromo,benzaldehyde, o-bromo,2-bromo benzaldehyde,bromobenzaldehyde,bromo benzaldehyde,o-bromo-benzaldehyde,2-formylbromobenzene,2-bromo-benzaldehyde,benzaldehyde, bromo
IUPAC Name 2-bromobenzaldehyde
InChI Key NDOPHXWIAZIXPR-UHFFFAOYSA-N
Molecular Formula C7H5BrO
3,855

Thermo Scientific Chemicals 3-Bromobenzylamine, 95%

CAS: 10269-01-9 Molecular Formula: C7H8BrN Molecular Weight (g/mol): 186.05 MDL Number: MFCD01026119 InChI Key: SUYJXERPRICYRX-UHFFFAOYSA-N Synonym: 3-bromobenzylamine,3-bromophenyl methanamine,benzenemethanamine, 3-bromo,3-bromophenyl methylamine,m-bromobenzylamine,1-3-bromophenyl methanamine,3-bromo-benzylamine,3-bromobenzenemethanamine,3-bromobenzyl amine,pubchem21109 PubChem CID: 457587 IUPAC Name: (3-bromophenyl)methanamine SMILES: C1=CC(=CC(=C1)Br)CN

PubChem CID 457587
CAS 10269-01-9
Molecular Weight (g/mol) 186.05
MDL Number MFCD01026119
SMILES C1=CC(=CC(=C1)Br)CN
Synonym 3-bromobenzylamine,3-bromophenyl methanamine,benzenemethanamine, 3-bromo,3-bromophenyl methylamine,m-bromobenzylamine,1-3-bromophenyl methanamine,3-bromo-benzylamine,3-bromobenzenemethanamine,3-bromobenzyl amine,pubchem21109
IUPAC Name (3-bromophenyl)methanamine
InChI Key SUYJXERPRICYRX-UHFFFAOYSA-N
Molecular Formula C7H8BrN