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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 (67,607)
Phenols (13,420)
Naphthalenes (5,064)
Fluorenes (1,235)
Unsubstituted Phenols (1,165)
Thiophenols (617)
Phenol esters (557)
Anthracenes (412)
Phenanthrenes and derivatives (327)
Tetralins (327)
Indanes (313)
Triphenyl compounds (277)
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Dibenzocycloheptenes (62)
Naphthacenes (36)
Ellagic acids and derivatives (33)
Pentacenes (19)
Pentacenequinones (16)
Acenaphthylenes (15)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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8,926 – 8,940 of 78,418 results
8,926

Ethyl 2-Bromobenzoate 98.0+%, TCI America™

CAS: 6091-64-1 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00015443 InChI Key: BIHHBTVQFPVSTE-UHFFFAOYSA-N Synonym: 2-bromobenzoic acid ethyl ester,benzoic acid, 2-bromo-, ethyl ester,ethyl-2-bromobenzoate,ethyl2-bromobenzoate,ethyl bromobenzoate,ethyl o-bromobenzoate,pubchem3937,brombenzoesaureathylester,acmc-209mn8,ksc493o4r PubChem CID: 80186 IUPAC Name: ethyl 2-bromobenzoate SMILES: CCOC(=O)C1=CC=CC=C1Br

PubChem CID 80186
CAS 6091-64-1
Molecular Weight (g/mol) 229.073
MDL Number MFCD00015443
SMILES CCOC(=O)C1=CC=CC=C1Br
Synonym 2-bromobenzoic acid ethyl ester,benzoic acid, 2-bromo-, ethyl ester,ethyl-2-bromobenzoate,ethyl2-bromobenzoate,ethyl bromobenzoate,ethyl o-bromobenzoate,pubchem3937,brombenzoesaureathylester,acmc-209mn8,ksc493o4r
IUPAC Name ethyl 2-bromobenzoate
InChI Key BIHHBTVQFPVSTE-UHFFFAOYSA-N
Molecular Formula C9H9BrO2
8,927

Bis(3-ethyl-5-methyl-4-maleimidophenyl)methane 98.0+%, TCI America™

CAS: 105391-33-1 Molecular Formula: C27H26N2O4 Molecular Weight (g/mol): 442.515 MDL Number: MFCD00467754 InChI Key: YNSSPVZNXLACMW-UHFFFAOYSA-N Synonym: Methylenebis(3-ethyl-5-methyl-4-maleimidobenzene) PubChem CID: 10950302 IUPAC Name: 1-[4-[[4-(2,5-dioxopyrrol-1-yl)-3-ethyl-5-methylphenyl]methyl]-2-ethyl-6-methylphenyl]pyrrole-2,5-dione SMILES: CCC1=CC(=CC(=C1N2C(=O)C=CC2=O)C)CC3=CC(=C(C(=C3)CC)N4C(=O)C=CC4=O)C

PubChem CID 10950302
CAS 105391-33-1
Molecular Weight (g/mol) 442.515
MDL Number MFCD00467754
SMILES CCC1=CC(=CC(=C1N2C(=O)C=CC2=O)C)CC3=CC(=C(C(=C3)CC)N4C(=O)C=CC4=O)C
Synonym Methylenebis(3-ethyl-5-methyl-4-maleimidobenzene)
IUPAC Name 1-[4-[[4-(2,5-dioxopyrrol-1-yl)-3-ethyl-5-methylphenyl]methyl]-2-ethyl-6-methylphenyl]pyrrole-2,5-dione
InChI Key YNSSPVZNXLACMW-UHFFFAOYSA-N
Molecular Formula C27H26N2O4
8,928

4-(Benzyloxy)benzyl Chloride 98.0+%, TCI America™

CAS: 836-42-0 Molecular Formula: C14H13ClO Molecular Weight (g/mol): 232.707 MDL Number: MFCD00000916 InChI Key: UYQPSKUPEXAQRJ-UHFFFAOYSA-N Synonym: Benzyl 4-(Chloromethyl)phenyl Ether, 1-(Benzyloxy)-4-(chloromethyl)benzene PubChem CID: 70042 IUPAC Name: 1-(chloromethyl)-4-phenylmethoxybenzene SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)CCl

PubChem CID 70042
CAS 836-42-0
Molecular Weight (g/mol) 232.707
MDL Number MFCD00000916
SMILES C1=CC=C(C=C1)COC2=CC=C(C=C2)CCl
Synonym Benzyl 4-(Chloromethyl)phenyl Ether, 1-(Benzyloxy)-4-(chloromethyl)benzene
IUPAC Name 1-(chloromethyl)-4-phenylmethoxybenzene
InChI Key UYQPSKUPEXAQRJ-UHFFFAOYSA-N
Molecular Formula C14H13ClO
8,929

3-Phenoxybenzyl Alcohol, TCI America™

CAS: 13826-35-2 Molecular Formula: C13H12O2 Molecular Weight (g/mol): 200.237 MDL Number: MFCD00004636 InChI Key: KGANAERDZBAECK-UHFFFAOYSA-N Synonym: 3-phenoxybenzyl alcohol,3-phenoxyphenyl methanol,3-phenoxybenzylalcohol,m-phenoxybenzyl alcohol,3-phenoxybenzenemethanol,benzenemethanol, 3-phenoxy,3-hydroxymethyl diphenyl ether,3-phenoxybenzylic alcohol,benzyl alcohol, m-phenoxy,3-pboh PubChem CID: 26295 ChEBI: CHEBI:62527 IUPAC Name: (3-phenoxyphenyl)methanol SMILES: C1=CC=C(C=C1)OC2=CC=CC(=C2)CO

PubChem CID 26295
CAS 13826-35-2
Molecular Weight (g/mol) 200.237
ChEBI CHEBI:62527
MDL Number MFCD00004636
SMILES C1=CC=C(C=C1)OC2=CC=CC(=C2)CO
Synonym 3-phenoxybenzyl alcohol,3-phenoxyphenyl methanol,3-phenoxybenzylalcohol,m-phenoxybenzyl alcohol,3-phenoxybenzenemethanol,benzenemethanol, 3-phenoxy,3-hydroxymethyl diphenyl ether,3-phenoxybenzylic alcohol,benzyl alcohol, m-phenoxy,3-pboh
IUPAC Name (3-phenoxyphenyl)methanol
InChI Key KGANAERDZBAECK-UHFFFAOYSA-N
Molecular Formula C13H12O2
8,930

Methyl 3-Hydroxy-4-nitrobenzoate 98.0+%, TCI America™

CAS: 713-52-0 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.146 MDL Number: MFCD00016997 InChI Key: UEGCRFNWTGYVKX-UHFFFAOYSA-N Synonym: benzoic acid, 3-hydroxy-4-nitro-, methyl ester,3-hydroxy-4-nitrobenzoic acid methyl ester,3-hydroxy-4-nitro-benzoic acid methyl ester,methyl 3-hydroxy-4-nitro-benzoate,methyl3-hydroxy-4-nitrobenzoate,pubchem20121,acmc-209oia,ksc379e5n,5-methoxycarbonyl-2-nitrophenol,methyl3-hydroxy-4-nitronemzoate PubChem CID: 294866 IUPAC Name: methyl 3-hydroxy-4-nitrobenzoate SMILES: COC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])O

PubChem CID 294866
CAS 713-52-0
Molecular Weight (g/mol) 197.146
MDL Number MFCD00016997
SMILES COC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])O
Synonym benzoic acid, 3-hydroxy-4-nitro-, methyl ester,3-hydroxy-4-nitrobenzoic acid methyl ester,3-hydroxy-4-nitro-benzoic acid methyl ester,methyl 3-hydroxy-4-nitro-benzoate,methyl3-hydroxy-4-nitrobenzoate,pubchem20121,acmc-209oia,ksc379e5n,5-methoxycarbonyl-2-nitrophenol,methyl3-hydroxy-4-nitronemzoate
IUPAC Name methyl 3-hydroxy-4-nitrobenzoate
InChI Key UEGCRFNWTGYVKX-UHFFFAOYSA-N
Molecular Formula C8H7NO5
8,931

Hexyl 4-Hydroxybenzoate 98.0+%, TCI America™

CAS: 1083-27-8 Molecular Formula: C13H18O3 Molecular Weight (g/mol): 222.284 MDL Number: MFCD00016480 InChI Key: ULULAZKOCFNOIM-UHFFFAOYSA-N Synonym: Hexylparaben, 4-Hydroxybenzoic Acid Hexyl Ester PubChem CID: 14127 IUPAC Name: hexyl 4-hydroxybenzoate SMILES: CCCCCCOC(=O)C1=CC=C(C=C1)O

PubChem CID 14127
CAS 1083-27-8
Molecular Weight (g/mol) 222.284
MDL Number MFCD00016480
SMILES CCCCCCOC(=O)C1=CC=C(C=C1)O
Synonym Hexylparaben, 4-Hydroxybenzoic Acid Hexyl Ester
IUPAC Name hexyl 4-hydroxybenzoate
InChI Key ULULAZKOCFNOIM-UHFFFAOYSA-N
Molecular Formula C13H18O3
8,932

(Triphenylphosphoranylidene)acetonitrile 98.0+%, TCI America™

CAS: 16640-68-9 Molecular Formula: C20H16NP Molecular Weight (g/mol): 301.33 MDL Number: MFCD00567633 InChI Key: APISVOVOJVZIBA-UHFFFAOYSA-N Synonym: triphenylphosphoranylidene acetonitrile,2-triphenylphosphoranylidene acetonitrile,cyanomethylene triphenylphosphorane,acetonitrile, triphenylphosphoranylidene,2-triphenyl-$l^ 5-phosphanylidene acetonitrile,2-triphenyl-??-phosphanylidene acetonitrile,acmc-1c6hd,ksc493a4b,cyanomethylenetriphenylphosphorane PubChem CID: 85524 IUPAC Name: 2-(triphenyl-λ⁵-phosphanylidene)acetonitrile SMILES: N#CC=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 85524
CAS 16640-68-9
Molecular Weight (g/mol) 301.33
MDL Number MFCD00567633
SMILES N#CC=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym triphenylphosphoranylidene acetonitrile,2-triphenylphosphoranylidene acetonitrile,cyanomethylene triphenylphosphorane,acetonitrile, triphenylphosphoranylidene,2-triphenyl-$l^ 5-phosphanylidene acetonitrile,2-triphenyl-??-phosphanylidene acetonitrile,acmc-1c6hd,ksc493a4b,cyanomethylenetriphenylphosphorane
IUPAC Name 2-(triphenyl-λ⁵-phosphanylidene)acetonitrile
InChI Key APISVOVOJVZIBA-UHFFFAOYSA-N
Molecular Formula C20H16NP
8,933

Isopropyl 4-Hydroxybenzoate 99.0+%, TCI America™

CAS: 4191-73-5 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 MDL Number: MFCD00016468 InChI Key: CMHMMKSPYOOVGI-UHFFFAOYSA-N Synonym: isopropyl 4-hydroxybenzoate,isopropylparaben,isopropyl p-hydroxybenzoate,isopropyl paraben,p-hydroxybenzoic acid isopropyl ester,isopropylhydroxybenzoate,unii-a6eox47qk0,p-oxybenzoesaureisopropylester,4-hydroxybenzoic acid isopropyl ester,benzoic acid, 4-hydroxy-, 1-methylethyl ester PubChem CID: 20161 IUPAC Name: propan-2-yl 4-hydroxybenzoate SMILES: CC(C)OC(=O)C1=CC=C(O)C=C1

PubChem CID 20161
CAS 4191-73-5
Molecular Weight (g/mol) 180.20
MDL Number MFCD00016468
SMILES CC(C)OC(=O)C1=CC=C(O)C=C1
Synonym isopropyl 4-hydroxybenzoate,isopropylparaben,isopropyl p-hydroxybenzoate,isopropyl paraben,p-hydroxybenzoic acid isopropyl ester,isopropylhydroxybenzoate,unii-a6eox47qk0,p-oxybenzoesaureisopropylester,4-hydroxybenzoic acid isopropyl ester,benzoic acid, 4-hydroxy-, 1-methylethyl ester
IUPAC Name propan-2-yl 4-hydroxybenzoate
InChI Key CMHMMKSPYOOVGI-UHFFFAOYSA-N
Molecular Formula C10H12O3
8,934

1-Phenyl-2-propanol 98.0+%, TCI America™

CAS: 698-87-3 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.19 MDL Number: MFCD00004540 InChI Key: WYTRYIUQUDTGSX-UHFFFAOYNA-N Synonym: Benzylmethylcarbinol PubChem CID: 94185 IUPAC Name: 1-phenylpropan-2-ol SMILES: CC(O)CC1=CC=CC=C1

PubChem CID 94185
CAS 698-87-3
Molecular Weight (g/mol) 136.19
MDL Number MFCD00004540
SMILES CC(O)CC1=CC=CC=C1
Synonym Benzylmethylcarbinol
IUPAC Name 1-phenylpropan-2-ol
InChI Key WYTRYIUQUDTGSX-UHFFFAOYNA-N
Molecular Formula C9H12O
8,935

4-(Trifluoromethylthio)aniline 98.0+%, TCI America™

CAS: 372-16-7 Molecular Formula: C7H6F3NS Molecular Weight (g/mol): 193.19 MDL Number: MFCD00040926 InChI Key: OHHHTUXVBNGOGI-UHFFFAOYSA-N Synonym: 4-trifluoromethylthio aniline,4-trifluoromethyl thio aniline,4-trifluoromethyl sulfanyl aniline,4-aminophenyl trifluoromethyl sulfide,4-aminophenyl trifluoromethyl sulphide,4-trifluoromethylsulfanyl aniline,benzenamine, 4-trifluoromethyl thio,4-trifluoromethylthio phenylamine PubChem CID: 123054 IUPAC Name: 4-[(trifluoromethyl)sulfanyl]aniline SMILES: NC1=CC=C(SC(F)(F)F)C=C1

PubChem CID 123054
CAS 372-16-7
Molecular Weight (g/mol) 193.19
MDL Number MFCD00040926
SMILES NC1=CC=C(SC(F)(F)F)C=C1
Synonym 4-trifluoromethylthio aniline,4-trifluoromethyl thio aniline,4-trifluoromethyl sulfanyl aniline,4-aminophenyl trifluoromethyl sulfide,4-aminophenyl trifluoromethyl sulphide,4-trifluoromethylsulfanyl aniline,benzenamine, 4-trifluoromethyl thio,4-trifluoromethylthio phenylamine
IUPAC Name 4-[(trifluoromethyl)sulfanyl]aniline
InChI Key OHHHTUXVBNGOGI-UHFFFAOYSA-N
Molecular Formula C7H6F3NS
8,936

Rhododendrol 98.0+%, TCI America™

CAS: 69617-84-1 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD01117650 InChI Key: SFUCGABQOMYVJW-UHFFFAOYNA-N Synonym: 4-(4-Hydroxyphenyl)-2-butanol, 4-(3-Hydroxybutyl)phenol PubChem CID: 97790 ChEBI: CHEBI:81278 IUPAC Name: 4-(3-hydroxybutyl)phenol SMILES: CC(O)CCC1=CC=C(O)C=C1

PubChem CID 97790
CAS 69617-84-1
Molecular Weight (g/mol) 166.22
ChEBI CHEBI:81278
MDL Number MFCD01117650
SMILES CC(O)CCC1=CC=C(O)C=C1
Synonym 4-(4-Hydroxyphenyl)-2-butanol, 4-(3-Hydroxybutyl)phenol
IUPAC Name 4-(3-hydroxybutyl)phenol
InChI Key SFUCGABQOMYVJW-UHFFFAOYNA-N
Molecular Formula C10H14O2
8,937

6-Amino-m-cresol 98.0+%, TCI America™

CAS: 2835-98-5 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.155 MDL Number: MFCD00007693 InChI Key: HCPJEHJGFKWRFM-UHFFFAOYSA-N Synonym: 6-amino-m-cresol,2-hydroxy-4-methylaniline,phenol, 2-amino-5-methyl,4-amino-3-hydroxytoluene,2-hydroxy-p-toluidine,unii-qcg4es2a26,6-amino-3-cresol,3-methyl-6-aminophenol,6-amino-3-methylphenol,qcg4es2a26 PubChem CID: 76082 IUPAC Name: 2-amino-5-methylphenol SMILES: CC1=CC(=C(C=C1)N)O

PubChem CID 76082
CAS 2835-98-5
Molecular Weight (g/mol) 123.155
MDL Number MFCD00007693
SMILES CC1=CC(=C(C=C1)N)O
Synonym 6-amino-m-cresol,2-hydroxy-4-methylaniline,phenol, 2-amino-5-methyl,4-amino-3-hydroxytoluene,2-hydroxy-p-toluidine,unii-qcg4es2a26,6-amino-3-cresol,3-methyl-6-aminophenol,6-amino-3-methylphenol,qcg4es2a26
IUPAC Name 2-amino-5-methylphenol
InChI Key HCPJEHJGFKWRFM-UHFFFAOYSA-N
Molecular Formula C7H9NO
8,938

4-sec-Butylphenol 98.0+%, TCI America™

CAS: 99-71-8 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00002375 InChI Key: ZUTYZAFDFLLILI-UHFFFAOYSA-N PubChem CID: 7453 ChEBI: CHEBI:34442 IUPAC Name: 4-butan-2-ylphenol SMILES: CCC(C)C1=CC=C(C=C1)O

PubChem CID 7453
CAS 99-71-8
Molecular Weight (g/mol) 150.221
ChEBI CHEBI:34442
MDL Number MFCD00002375
SMILES CCC(C)C1=CC=C(C=C1)O
IUPAC Name 4-butan-2-ylphenol
InChI Key ZUTYZAFDFLLILI-UHFFFAOYSA-N
Molecular Formula C10H14O
8,939

1-Fluoro-3-(trifluoromethoxy)benzene 98.0+%, TCI America™

CAS: 1077-01-6 Molecular Formula: C7H4F4O Molecular Weight (g/mol): 180.102 MDL Number: MFCD00236323 InChI Key: AUKDFDQPJWJEDH-UHFFFAOYSA-N PubChem CID: 2777286 IUPAC Name: 1-fluoro-3-(trifluoromethoxy)benzene SMILES: C1=CC(=CC(=C1)F)OC(F)(F)F

PubChem CID 2777286
CAS 1077-01-6
Molecular Weight (g/mol) 180.102
MDL Number MFCD00236323
SMILES C1=CC(=CC(=C1)F)OC(F)(F)F
IUPAC Name 1-fluoro-3-(trifluoromethoxy)benzene
InChI Key AUKDFDQPJWJEDH-UHFFFAOYSA-N
Molecular Formula C7H4F4O
8,940

1,3-Bis[4-(trifluoromethyl)phenyl]urea 98.0+%, TCI America™

CAS: 1960-88-9 Molecular Formula: C15H10F6N2O Molecular Weight (g/mol): 348.248 MDL Number: MFCD01908917 InChI Key: PEXQIAHZLFTVJU-UHFFFAOYSA-N Synonym: 1,3-bis 4-trifluoromethyl phenyl urea,maybridge4_001077,1,3-bis 4-trifluoromethylphenyl urea,n,n'-bis-4-trifluoromethylphenyl-urea,urea, n,n'-bis 4-trifluoromethyl phenyl PubChem CID: 472928 IUPAC Name: 1,3-bis[4-(trifluoromethyl)phenyl]urea SMILES: C1=CC(=CC=C1C(F)(F)F)NC(=O)NC2=CC=C(C=C2)C(F)(F)F

PubChem CID 472928
CAS 1960-88-9
Molecular Weight (g/mol) 348.248
MDL Number MFCD01908917
SMILES C1=CC(=CC=C1C(F)(F)F)NC(=O)NC2=CC=C(C=C2)C(F)(F)F
Synonym 1,3-bis 4-trifluoromethyl phenyl urea,maybridge4_001077,1,3-bis 4-trifluoromethylphenyl urea,n,n'-bis-4-trifluoromethylphenyl-urea,urea, n,n'-bis 4-trifluoromethyl phenyl
IUPAC Name 1,3-bis[4-(trifluoromethyl)phenyl]urea
InChI Key PEXQIAHZLFTVJU-UHFFFAOYSA-N
Molecular Formula C15H10F6N2O