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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.
Benzene and substituted derivatives (129,562)
Phenols (24,872)
Naphthalenes (6,288)
Phenol esters (4,683)
Unsubstituted Phenols (1,436)
Fluorenes (1,296)
Thiophenols (747)
Anthracenes (509)
Indanes (489)
Phenanthrenes and derivatives (364)
Tetralins (339)
Pyrenes (281)
Triphenyl compounds (278)
Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (22)
Acenaphthylenes (17)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (5)

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2,311 – 2,325 of 158,052 results
2,311
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Benzylideneacetone, 98+%

CAS: 122-57-6 Molecular Formula: C10H10O Molecular Weight (g/mol): 146.19 MDL Number: MFCD00008779 InChI Key: BWHOZHOGCMHOBV-BQYQJAHWSA-N Synonym: benzalacetone,benzylideneacetone,methyl styryl ketone,4-phenylbut-3-en-2-one,acetocinnamone,4-phenyl-3-buten-2-one,e-4-phenylbut-3-en-2-one,benzylidene acetone,trans-benzalacetone,benzalaceton PubChem CID: 637759 ChEBI: CHEBI:78399 SMILES: CC(=O)\C=C\C1=CC=CC=C1

PubChem CID 637759
CAS 122-57-6
Molecular Weight (g/mol) 146.19
ChEBI CHEBI:78399
MDL Number MFCD00008779
SMILES CC(=O)\C=C\C1=CC=CC=C1
Synonym benzalacetone,benzylideneacetone,methyl styryl ketone,4-phenylbut-3-en-2-one,acetocinnamone,4-phenyl-3-buten-2-one,e-4-phenylbut-3-en-2-one,benzylidene acetone,trans-benzalacetone,benzalaceton
InChI Key BWHOZHOGCMHOBV-BQYQJAHWSA-N
Molecular Formula C10H10O
2,312
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N-Acetyl-N'-phenylhydrazine, 98%

CAS: 114-83-0 Molecular Formula: C8H10N2O Molecular Weight (g/mol): 150.181 MDL Number: MFCD00008672 InChI Key: UICBCXONCUFSOI-UHFFFAOYSA-N Synonym: 1-acetyl-2-phenylhydrazine,hydracetin,acetylphenylhydrazine,pyrodin,pyrodine,acetic acid, 2-phenylhydrazide,n-acetyl-n'-phenylhydrazine,n'-phenylacethydrazide,acetic acid phenylhydrazone,n 1-acetylphenylhydrazine PubChem CID: 8247 IUPAC Name: N'-phenylacetohydrazide SMILES: CC(=O)NNC1=CC=CC=C1

PubChem CID 8247
CAS 114-83-0
Molecular Weight (g/mol) 150.181
MDL Number MFCD00008672
SMILES CC(=O)NNC1=CC=CC=C1
Synonym 1-acetyl-2-phenylhydrazine,hydracetin,acetylphenylhydrazine,pyrodin,pyrodine,acetic acid, 2-phenylhydrazide,n-acetyl-n'-phenylhydrazine,n'-phenylacethydrazide,acetic acid phenylhydrazone,n 1-acetylphenylhydrazine
IUPAC Name N'-phenylacetohydrazide
InChI Key UICBCXONCUFSOI-UHFFFAOYSA-N
Molecular Formula C8H10N2O
2,313
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3,5-Dimethoxybenzoic acid, 99%

CAS: 1132-21-4 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00002502 InChI Key: IWPZKOJSYQZABD-UHFFFAOYSA-N Synonym: benzoic acid, 3,5-dimethoxy,unii-38my78eckk,3,5-dimethoxy benzoic acid,38my78eckk,pubchem3121,3,5-dimethoxybenzoicacid,acmc-1c4zl,3,5-dimethoxy-benzoic acid,ksc176m0p,benzoicacid, 3,5-dimethoxy PubChem CID: 14332 IUPAC Name: 3,5-dimethoxybenzoic acid SMILES: COC1=CC(=CC(OC)=C1)C(O)=O

PubChem CID 14332
CAS 1132-21-4
Molecular Weight (g/mol) 182.18
MDL Number MFCD00002502
SMILES COC1=CC(=CC(OC)=C1)C(O)=O
Synonym benzoic acid, 3,5-dimethoxy,unii-38my78eckk,3,5-dimethoxy benzoic acid,38my78eckk,pubchem3121,3,5-dimethoxybenzoicacid,acmc-1c4zl,3,5-dimethoxy-benzoic acid,ksc176m0p,benzoicacid, 3,5-dimethoxy
IUPAC Name 3,5-dimethoxybenzoic acid
InChI Key IWPZKOJSYQZABD-UHFFFAOYSA-N
Molecular Formula C9H10O4
2,314
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1-tert-Butyl-4-iodobenzene, 97%

CAS: 35779-04-5 Molecular Formula: C10H13I Molecular Weight (g/mol): 260.118 MDL Number: MFCD00052339 InChI Key: WQVIVQDHNKQWTM-UHFFFAOYSA-N Synonym: 1-tert-butyl-4-iodobenzene,4-tert-butyliodobenzene,4-t-butyliodobenzene,1-iodo-4-tert-butylbenzene,benzene, 1-1,1-dimethylethyl-4-iodo,4-tert-butyl-1-iodobenzene,2-4-iodophenyl-2-methylpropane,2-4'-iodophenyl-2-methylpropane,pubchem3974,4-t-butyl-iodobenzene PubChem CID: 142029 IUPAC Name: 1-tert-butyl-4-iodobenzene SMILES: CC(C)(C)C1=CC=C(C=C1)I

PubChem CID 142029
CAS 35779-04-5
Molecular Weight (g/mol) 260.118
MDL Number MFCD00052339
SMILES CC(C)(C)C1=CC=C(C=C1)I
Synonym 1-tert-butyl-4-iodobenzene,4-tert-butyliodobenzene,4-t-butyliodobenzene,1-iodo-4-tert-butylbenzene,benzene, 1-1,1-dimethylethyl-4-iodo,4-tert-butyl-1-iodobenzene,2-4-iodophenyl-2-methylpropane,2-4'-iodophenyl-2-methylpropane,pubchem3974,4-t-butyl-iodobenzene
IUPAC Name 1-tert-butyl-4-iodobenzene
InChI Key WQVIVQDHNKQWTM-UHFFFAOYSA-N
Molecular Formula C10H13I
2,315
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Tolylene 2,4-diisocyanate, 75%, technical

CAS: 584-84-9 Molecular Formula: C9H6N2O2 Molecular Weight (g/mol): 174.16 InChI Key: DVKJHBMWWAPEIU-UHFFFAOYSA-N Synonym: 2,4-toluene diisocyanate,2,4-diisocyanatotoluene,tolylene-2,4-diisocyanate,toluene-2,4-diisocyanate,2,4-tolylene diisocyanate,toluene 2,4-diisocyanate,4-methyl-m-phenylene diisocyanate,tolylene diisocyanate,2,4-tdi,toluylene-2,4-diisocyanate PubChem CID: 11443 ChEBI: CHEBI:53556 IUPAC Name: 2,4-diisocyanato-1-methylbenzene SMILES: CC1=C(C=C(C=C1)N=C=O)N=C=O

PubChem CID 11443
CAS 584-84-9
Molecular Weight (g/mol) 174.16
ChEBI CHEBI:53556
SMILES CC1=C(C=C(C=C1)N=C=O)N=C=O
Synonym 2,4-toluene diisocyanate,2,4-diisocyanatotoluene,tolylene-2,4-diisocyanate,toluene-2,4-diisocyanate,2,4-tolylene diisocyanate,toluene 2,4-diisocyanate,4-methyl-m-phenylene diisocyanate,tolylene diisocyanate,2,4-tdi,toluylene-2,4-diisocyanate
IUPAC Name 2,4-diisocyanato-1-methylbenzene
InChI Key DVKJHBMWWAPEIU-UHFFFAOYSA-N
Molecular Formula C9H6N2O2
2,316
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p-Benzoquinone dioxime, 95%

CAS: 105-11-3 Molecular Formula: C6H6N2O2 Molecular Weight (g/mol): 138.13 MDL Number: MFCD00063636 InChI Key: LNHURPJLTHSVMU-CGXWXWIYSA-N Synonym: 1,4-benzoquinone dioxime,p-benzoquinonedioxime,p-benzoquinone dioxime,p-quinone dioxime,quinone dioxime,benzoquinone dioxime,p-quinone oxime,actor q,dioxime p-benzoquinone,dibenzo pqd PubChem CID: 7737 IUPAC Name: N-(4-nitrosophenyl)hydroxylamine SMILES: ON=C1C=CC(C=C1)=NO

PubChem CID 7737
CAS 105-11-3
Molecular Weight (g/mol) 138.13
MDL Number MFCD00063636
SMILES ON=C1C=CC(C=C1)=NO
Synonym 1,4-benzoquinone dioxime,p-benzoquinonedioxime,p-benzoquinone dioxime,p-quinone dioxime,quinone dioxime,benzoquinone dioxime,p-quinone oxime,actor q,dioxime p-benzoquinone,dibenzo pqd
IUPAC Name N-(4-nitrosophenyl)hydroxylamine
InChI Key LNHURPJLTHSVMU-CGXWXWIYSA-N
Molecular Formula C6H6N2O2
2,317
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2-Fluoro-5-nitrobenzotrifluoride, 98%

CAS: 400-74-8 Molecular Formula: C7H3F4NO2 Molecular Weight (g/mol): 209.1 MDL Number: MFCD00024576 InChI Key: DNTHMWUMRGOJRY-UHFFFAOYSA-N Synonym: 2-fluoro-5-nitrobenzotrifluoride,1-fluoro-4-nitro-2-trifluoromethyl benzene,benzene, 1-fluoro-4-nitro-2-trifluoromethyl,alpha,alpha,alpha-2-tetrafluorotoluene,2-fluoro-5-nitro trifluoromethyl benzene,1-fluoro-4-nitro-2-trifluoromethyl-benzene,1-fluoro-2-trifluoromethyl-4-nitrobenzene,5-nitro-alpha,alpha,alpha,2-tetrafluorotoluene,pubchem1653,2-fluor-5-nitrobenzotrifluorid PubChem CID: 94954 IUPAC Name: 1-fluoro-4-nitro-2-(trifluoromethyl)benzene SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)F

PubChem CID 94954
CAS 400-74-8
Molecular Weight (g/mol) 209.1
MDL Number MFCD00024576
SMILES C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)F
Synonym 2-fluoro-5-nitrobenzotrifluoride,1-fluoro-4-nitro-2-trifluoromethyl benzene,benzene, 1-fluoro-4-nitro-2-trifluoromethyl,alpha,alpha,alpha-2-tetrafluorotoluene,2-fluoro-5-nitro trifluoromethyl benzene,1-fluoro-4-nitro-2-trifluoromethyl-benzene,1-fluoro-2-trifluoromethyl-4-nitrobenzene,5-nitro-alpha,alpha,alpha,2-tetrafluorotoluene,pubchem1653,2-fluor-5-nitrobenzotrifluorid
IUPAC Name 1-fluoro-4-nitro-2-(trifluoromethyl)benzene
InChI Key DNTHMWUMRGOJRY-UHFFFAOYSA-N
Molecular Formula C7H3F4NO2
2,318
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4-Methoxyphenylglyoxal hydrate, 95%, dry wt. basis

CAS: 16208-17-6 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00234534 InChI Key: NLUFPYPVEHQAQN-UHFFFAOYSA-N Synonym: 4-methoxyphenylglyoxal hydrate,2-4-methoxyphenyl-2-oxoacetaldehyde hydrate,pubchem12129,acmc-20ai17,4-methoxyphenyl glyoxal hydrate,p-methoxyphenylglyoxal monohydrate,2-4-methoxyphenyl-2-oxoethanal, hydrate,ethanone,2,2-dihydroxy-1-4-methoxyphenyl,4-methoxyphenyl oxo acetaldehyde-water 1/1,2-4-methoxyphenyl-2-oxidanylidene-ethanal hydrate PubChem CID: 15556730 IUPAC Name: 2-(4-methoxyphenyl)-2-oxoacetaldehyde;hydrate SMILES: COC1=CC=C(C=C1)C(=O)C(O)O

PubChem CID 15556730
CAS 16208-17-6
Molecular Weight (g/mol) 182.18
MDL Number MFCD00234534
SMILES COC1=CC=C(C=C1)C(=O)C(O)O
Synonym 4-methoxyphenylglyoxal hydrate,2-4-methoxyphenyl-2-oxoacetaldehyde hydrate,pubchem12129,acmc-20ai17,4-methoxyphenyl glyoxal hydrate,p-methoxyphenylglyoxal monohydrate,2-4-methoxyphenyl-2-oxoethanal, hydrate,ethanone,2,2-dihydroxy-1-4-methoxyphenyl,4-methoxyphenyl oxo acetaldehyde-water 1/1,2-4-methoxyphenyl-2-oxidanylidene-ethanal hydrate
IUPAC Name 2-(4-methoxyphenyl)-2-oxoacetaldehyde;hydrate
InChI Key NLUFPYPVEHQAQN-UHFFFAOYSA-N
Molecular Formula C9H10O4
2,319
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Dibenzylamine, 98%

CAS: 103-49-1 Molecular Formula: C14H15N Molecular Weight (g/mol): 197.28 MDL Number: MFCD00004770 InChI Key: BWLUMTFWVZZZND-UHFFFAOYSA-N Synonym: dibenzylamine,benzenemethanamine, n-phenylmethyl,n-benzylbenzylamine,bibenzylamine,dibenzyl-amine,dibenzyl amine,bisbenzylamine,n,n-dibenzylamine,n-benzylaminomethyl benzene,unii-3g0yfx01c6 PubChem CID: 7656 SMILES: C(NCC1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 7656
CAS 103-49-1
Molecular Weight (g/mol) 197.28
MDL Number MFCD00004770
SMILES C(NCC1=CC=CC=C1)C1=CC=CC=C1
Synonym dibenzylamine,benzenemethanamine, n-phenylmethyl,n-benzylbenzylamine,bibenzylamine,dibenzyl-amine,dibenzyl amine,bisbenzylamine,n,n-dibenzylamine,n-benzylaminomethyl benzene,unii-3g0yfx01c6
InChI Key BWLUMTFWVZZZND-UHFFFAOYSA-N
Molecular Formula C14H15N
2,320
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Triphenylacetic acid, 99%

CAS: 595-91-5 Molecular Formula: C20H16O2 Molecular Weight (g/mol): 288.35 MDL Number: MFCD00004185 InChI Key: DCYGAPKNVCQNOE-UHFFFAOYSA-N Synonym: triphenylacetic acid,acetic acid, triphenyl,triphenyl acetic acid,benzeneacetic acid, .alpha.,.alpha.-diphenyl,nsc 61,tri phenylacetic acid,pubchem9200,alpha-toluic acid, alpha,alpha-diphenyl,acmc-1arvb,maybridge1_006927 PubChem CID: 68992 IUPAC Name: 2,2,2-triphenylacetic acid SMILES: OC(=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 68992
CAS 595-91-5
Molecular Weight (g/mol) 288.35
MDL Number MFCD00004185
SMILES OC(=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym triphenylacetic acid,acetic acid, triphenyl,triphenyl acetic acid,benzeneacetic acid, .alpha.,.alpha.-diphenyl,nsc 61,tri phenylacetic acid,pubchem9200,alpha-toluic acid, alpha,alpha-diphenyl,acmc-1arvb,maybridge1_006927
IUPAC Name 2,2,2-triphenylacetic acid
InChI Key DCYGAPKNVCQNOE-UHFFFAOYSA-N
Molecular Formula C20H16O2
2,321
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5-Amino-2-methoxyphenol, 98%

CAS: 1687-53-2 Molecular Formula: C7H9NO2 Molecular Weight (g/mol): 139.154 MDL Number: MFCD00010222 InChI Key: BLQFHJKRTDIZLX-UHFFFAOYSA-N Synonym: 3-hydroxy-4-methoxyaniline,5-aminoguaiacol,2-methoxy-5-aminophenol,phenol, 5-amino-2-methoxy,5-amino-2-methoxy-phenol,pubchem3112,acmc-209dyt,3-hydroxy4-methoxyaniline,5-amino-2-methoxy phenol,3-hydroxy-4-methoxylaniline PubChem CID: 74314 IUPAC Name: 5-amino-2-methoxyphenol SMILES: COC1=C(C=C(C=C1)N)O

PubChem CID 74314
CAS 1687-53-2
Molecular Weight (g/mol) 139.154
MDL Number MFCD00010222
SMILES COC1=C(C=C(C=C1)N)O
Synonym 3-hydroxy-4-methoxyaniline,5-aminoguaiacol,2-methoxy-5-aminophenol,phenol, 5-amino-2-methoxy,5-amino-2-methoxy-phenol,pubchem3112,acmc-209dyt,3-hydroxy4-methoxyaniline,5-amino-2-methoxy phenol,3-hydroxy-4-methoxylaniline
IUPAC Name 5-amino-2-methoxyphenol
InChI Key BLQFHJKRTDIZLX-UHFFFAOYSA-N
Molecular Formula C7H9NO2
2,322
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3-(Methylthio)phenyl isocyanate, 96%

CAS: 28479-19-8 Molecular Formula: C8H7NOS Molecular Weight (g/mol): 165.21 MDL Number: MFCD00013863 InChI Key: BKJABLMNBSVKCV-UHFFFAOYSA-N Synonym: 3-methylthio phenyl isocyanate,1-isocyanato-3-methylthio benzene,3-methylthiophenyl isocyanate,1-isocyanato-3-methylsulfanyl benzene,1-isocyanato-3-methylsulfanyl-benzene,3-methylthio phenylisocyanate,benzene, 1-isocyanato-3-methylthio,3-methylthiobenzenisocyanate,acmc-20anig,pubchem14329 PubChem CID: 141418 IUPAC Name: 1-isocyanato-3-methylsulfanylbenzene SMILES: CSC1=CC=CC(=C1)N=C=O

PubChem CID 141418
CAS 28479-19-8
Molecular Weight (g/mol) 165.21
MDL Number MFCD00013863
SMILES CSC1=CC=CC(=C1)N=C=O
Synonym 3-methylthio phenyl isocyanate,1-isocyanato-3-methylthio benzene,3-methylthiophenyl isocyanate,1-isocyanato-3-methylsulfanyl benzene,1-isocyanato-3-methylsulfanyl-benzene,3-methylthio phenylisocyanate,benzene, 1-isocyanato-3-methylthio,3-methylthiobenzenisocyanate,acmc-20anig,pubchem14329
IUPAC Name 1-isocyanato-3-methylsulfanylbenzene
InChI Key BKJABLMNBSVKCV-UHFFFAOYSA-N
Molecular Formula C8H7NOS
2,323
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3-(Trifluoromethyl)phenylhydrazine, 95%

CAS: 368-78-5 Molecular Formula: C7H7F3N2 Molecular Weight (g/mol): 176.142 MDL Number: MFCD00025093 InChI Key: RSESUCWJKLHXEZ-UHFFFAOYSA-N Synonym: 3-trifluoromethyl phenylhydrazine,3-trifluoromethyl phenyl hydrazine,3-trifluoromethylphenylhydrazine,hydrazine, 3-trifluoromethyl phenyl,3-trifloromethylphenylhydrazine,3-trifluouromethyl phenylhydrazinehydrochloride,3-trifluoromethyl phenylhydrazine hydrochioride,pubchem3280,enamine_001261 PubChem CID: 98650 IUPAC Name: [3-(trifluoromethyl)phenyl]hydrazine SMILES: C1=CC(=CC(=C1)NN)C(F)(F)F

PubChem CID 98650
CAS 368-78-5
Molecular Weight (g/mol) 176.142
MDL Number MFCD00025093
SMILES C1=CC(=CC(=C1)NN)C(F)(F)F
Synonym 3-trifluoromethyl phenylhydrazine,3-trifluoromethyl phenyl hydrazine,3-trifluoromethylphenylhydrazine,hydrazine, 3-trifluoromethyl phenyl,3-trifloromethylphenylhydrazine,3-trifluouromethyl phenylhydrazinehydrochloride,3-trifluoromethyl phenylhydrazine hydrochioride,pubchem3280,enamine_001261
IUPAC Name [3-(trifluoromethyl)phenyl]hydrazine
InChI Key RSESUCWJKLHXEZ-UHFFFAOYSA-N
Molecular Formula C7H7F3N2
2,324
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3-Hydroxyphenylacetylene, 97%

CAS: 10401-11-3 Molecular Formula: C8H6O Molecular Weight (g/mol): 118.14 MDL Number: MFCD00078347 InChI Key: AODMJIOEGCBUQL-UHFFFAOYSA-N Synonym: 3-hydroxyphenylacetylene,phenol, 3-ethynyl,m-ethynylphenol,3-ethynyl-phenol,#,3-hydroxy-phenylacetylene,3-hydroxyphenyl acetylene,3-hydroxy-1-ethynylbenzene,phenol, 3-ethynyl-9ci PubChem CID: 139144 IUPAC Name: 3-ethynylphenol SMILES: OC1=CC=CC(=C1)C#C

PubChem CID 139144
CAS 10401-11-3
Molecular Weight (g/mol) 118.14
MDL Number MFCD00078347
SMILES OC1=CC=CC(=C1)C#C
Synonym 3-hydroxyphenylacetylene,phenol, 3-ethynyl,m-ethynylphenol,3-ethynyl-phenol,#,3-hydroxy-phenylacetylene,3-hydroxyphenyl acetylene,3-hydroxy-1-ethynylbenzene,phenol, 3-ethynyl-9ci
IUPAC Name 3-ethynylphenol
InChI Key AODMJIOEGCBUQL-UHFFFAOYSA-N
Molecular Formula C8H6O
2,325
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5-Hydroxy-2-nitrobenzaldehyde, 97%, Thermo Scientific Chemicals

CAS: 42454-06-8 Molecular Formula: C7H5NO4 Molecular Weight (g/mol): 167.12 MDL Number: MFCD00007332 InChI Key: XLYPHUGUKGMURE-UHFFFAOYSA-N Synonym: 3-formyl-4-nitrophenol,6-nitro-3-hydroxybenzaldehyde,2-nitro-5-hydroxybenzaldehyde,5-hydroxy-2-nitro-benzaldehyde,benzaldehyde, 5-hydroxy-2-nitro,unii-va926z93if,6-nitro-3-hydroxy benzaldhyde,pubchem8205,acmc-1an3l,4-08-00-00250 beilstein handbook reference PubChem CID: 39211 IUPAC Name: 5-hydroxy-2-nitrobenzaldehyde SMILES: OC1=CC=C(C(C=O)=C1)[N+]([O-])=O

PubChem CID 39211
CAS 42454-06-8
Molecular Weight (g/mol) 167.12
MDL Number MFCD00007332
SMILES OC1=CC=C(C(C=O)=C1)[N+]([O-])=O
Synonym 3-formyl-4-nitrophenol,6-nitro-3-hydroxybenzaldehyde,2-nitro-5-hydroxybenzaldehyde,5-hydroxy-2-nitro-benzaldehyde,benzaldehyde, 5-hydroxy-2-nitro,unii-va926z93if,6-nitro-3-hydroxy benzaldhyde,pubchem8205,acmc-1an3l,4-08-00-00250 beilstein handbook reference
IUPAC Name 5-hydroxy-2-nitrobenzaldehyde
InChI Key XLYPHUGUKGMURE-UHFFFAOYSA-N
Molecular Formula C7H5NO4