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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 (67,621)
Phenols (13,427)
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)
Pyrenes (229)
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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10,186 – 10,200 of 78,439 results
10,186

2,2-Bis(4-chlorophenyl)-1,1-dichloroethane 98.0+%, TCI America™

CAS: 72-54-8 Molecular Formula: C14H10Cl4 Molecular Weight (g/mol): 320.034 MDL Number: MFCD00000851 InChI Key: AHJKRLASYNVKDZ-UHFFFAOYSA-N Synonym: p,p'-ddd,rhothane,dilene,tetrachlorodiphenylethane,dichlorodiphenyldichloroethane,p,p'-tde,rothane,rhothane d-3,4,4'-ddd,1,1-dichloro-2,2-bis p-chlorophenyl ethane PubChem CID: 6294 ChEBI: CHEBI:27841 IUPAC Name: 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethyl]benzene SMILES: C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)C(Cl)Cl)Cl

PubChem CID 6294
CAS 72-54-8
Molecular Weight (g/mol) 320.034
ChEBI CHEBI:27841
MDL Number MFCD00000851
SMILES C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)C(Cl)Cl)Cl
Synonym p,p'-ddd,rhothane,dilene,tetrachlorodiphenylethane,dichlorodiphenyldichloroethane,p,p'-tde,rothane,rhothane d-3,4,4'-ddd,1,1-dichloro-2,2-bis p-chlorophenyl ethane
IUPAC Name 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethyl]benzene
InChI Key AHJKRLASYNVKDZ-UHFFFAOYSA-N
Molecular Formula C14H10Cl4
10,187

4-(trans-4-Ethylcyclohexyl)benzoic Acid 98.0+%, TCI America™

CAS: 87592-41-4 Molecular Formula: C15H20O2 Molecular Weight (g/mol): 232.323 MDL Number: MFCD06658176 InChI Key: DUJHWZDXZFNEKU-UHFFFAOYSA-N PubChem CID: 13955174 IUPAC Name: 4-(4-ethylcyclohexyl)benzoic acid SMILES: CCC1CCC(CC1)C2=CC=C(C=C2)C(=O)O

PubChem CID 13955174
CAS 87592-41-4
Molecular Weight (g/mol) 232.323
MDL Number MFCD06658176
SMILES CCC1CCC(CC1)C2=CC=C(C=C2)C(=O)O
IUPAC Name 4-(4-ethylcyclohexyl)benzoic acid
InChI Key DUJHWZDXZFNEKU-UHFFFAOYSA-N
Molecular Formula C15H20O2
10,188

2-Bromo-5-chlorobenzaldehyde 97.0+%, TCI America™

CAS: 174265-12-4 Molecular Formula: C7H4BrClO Molecular Weight (g/mol): 219.462 InChI Key: IIISHLMCTDMUHH-UHFFFAOYSA-N Synonym: 5-chloro-2-bromobenzaldehyde,benzaldehyde, 2-bromo-5-chloro,pubchem19849,acmc-1bwmm,ksc174i5n,2-bromo-5-chlorobenzaldehycle,iiishlmctdmuhh-uhfffaoysa PubChem CID: 15391279 IUPAC Name: 2-bromo-5-chlorobenzaldehyde SMILES: C1=CC(=C(C=C1Cl)C=O)Br

PubChem CID 15391279
CAS 174265-12-4
Molecular Weight (g/mol) 219.462
SMILES C1=CC(=C(C=C1Cl)C=O)Br
Synonym 5-chloro-2-bromobenzaldehyde,benzaldehyde, 2-bromo-5-chloro,pubchem19849,acmc-1bwmm,ksc174i5n,2-bromo-5-chlorobenzaldehycle,iiishlmctdmuhh-uhfffaoysa
IUPAC Name 2-bromo-5-chlorobenzaldehyde
InChI Key IIISHLMCTDMUHH-UHFFFAOYSA-N
Molecular Formula C7H4BrClO
10,189

5-Fluoro-2-methylbenzaldehyde 95.0+%, TCI America™

CAS: 22062-53-9 Molecular Formula: C8H7FO Molecular Weight (g/mol): 138.141 MDL Number: MFCD02261763 InChI Key: MBOXPKNOGZJXPK-UHFFFAOYSA-N Synonym: 5-fluoro-2-methyl-benzaldehyde,benzaldehyde, 5-fluoro-2-methyl,zlchem 996,pubchem1458,acmc-209fri,ksc494k1f,2-methyl-5-fluorobenzaldehyde,5-fluoro-2-methylbenzaldehyde PubChem CID: 2759012 IUPAC Name: 5-fluoro-2-methylbenzaldehyde SMILES: CC1=C(C=C(C=C1)F)C=O

PubChem CID 2759012
CAS 22062-53-9
Molecular Weight (g/mol) 138.141
MDL Number MFCD02261763
SMILES CC1=C(C=C(C=C1)F)C=O
Synonym 5-fluoro-2-methyl-benzaldehyde,benzaldehyde, 5-fluoro-2-methyl,zlchem 996,pubchem1458,acmc-209fri,ksc494k1f,2-methyl-5-fluorobenzaldehyde,5-fluoro-2-methylbenzaldehyde
IUPAC Name 5-fluoro-2-methylbenzaldehyde
InChI Key MBOXPKNOGZJXPK-UHFFFAOYSA-N
Molecular Formula C8H7FO
10,190

4-Diethylaminobenzaldehyde 99.0+%, TCI America™

CAS: 120-21-8 Molecular Formula: C11H15NO Molecular Weight (g/mol): 177.247 MDL Number: MFCD00003382 InChI Key: MNFZZNNFORDXSV-UHFFFAOYSA-N Synonym: 4-diethylamino benzaldehyde,benzaldehyde, 4-diethylamino,p-diethylamino benzaldehyde,p-formyl-n,n-diethylaniline,4-diethylamino-benzaldehyde,benzaldehyde, p-diethylamino,unii-s640xwl10h,p-n,n-diethylaminobenzaldehyde,p-diethylaminobenzaldehyde,4-n,n-diethylamino benzaldehyde PubChem CID: 67114 ChEBI: CHEBI:86194 IUPAC Name: 4-(diethylamino)benzaldehyde SMILES: CCN(CC)C1=CC=C(C=C1)C=O

PubChem CID 67114
CAS 120-21-8
Molecular Weight (g/mol) 177.247
ChEBI CHEBI:86194
MDL Number MFCD00003382
SMILES CCN(CC)C1=CC=C(C=C1)C=O
Synonym 4-diethylamino benzaldehyde,benzaldehyde, 4-diethylamino,p-diethylamino benzaldehyde,p-formyl-n,n-diethylaniline,4-diethylamino-benzaldehyde,benzaldehyde, p-diethylamino,unii-s640xwl10h,p-n,n-diethylaminobenzaldehyde,p-diethylaminobenzaldehyde,4-n,n-diethylamino benzaldehyde
IUPAC Name 4-(diethylamino)benzaldehyde
InChI Key MNFZZNNFORDXSV-UHFFFAOYSA-N
Molecular Formula C11H15NO
10,191

4,4'-Biphenyldicarboxylic Acid 97.0+%, TCI America™

CAS: 787-70-2 Molecular Formula: C14H10O4 Molecular Weight (g/mol): 242.23 MDL Number: MFCD00002554 InChI Key: NEQFBGHQPUXOFH-UHFFFAOYSA-N Synonym: biphenyl-4,4'-dicarboxylic acid,4,4'-biphenyldicarboxylic acid,1,1'-biphenyl-4,4'-dicarboxylic acid,4-4-carboxyphenyl benzoic acid,4,4'-bibenzoic acid,4,4'-diphenic acid,4,4'-dicarboxybiphenyl,p,p'-diphenic acid,usaf do-69,bibenzoic acid PubChem CID: 13084 IUPAC Name: 4-(4-carboxyphenyl)benzoic acid SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)O)C(=O)O

PubChem CID 13084
CAS 787-70-2
Molecular Weight (g/mol) 242.23
MDL Number MFCD00002554
SMILES C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)O)C(=O)O
Synonym biphenyl-4,4'-dicarboxylic acid,4,4'-biphenyldicarboxylic acid,1,1'-biphenyl-4,4'-dicarboxylic acid,4-4-carboxyphenyl benzoic acid,4,4'-bibenzoic acid,4,4'-diphenic acid,4,4'-dicarboxybiphenyl,p,p'-diphenic acid,usaf do-69,bibenzoic acid
IUPAC Name 4-(4-carboxyphenyl)benzoic acid
InChI Key NEQFBGHQPUXOFH-UHFFFAOYSA-N
Molecular Formula C14H10O4
10,192

Ethyl p-Toluate 99.0+%, TCI America™

CAS: 94-08-6 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00009117 InChI Key: NWPWRAWAUYIELB-UHFFFAOYSA-N Synonym: ethyl p-toluate,ethyl p-methylbenzoate,benzoic acid, 4-methyl-, ethyl ester,4-methylbenzoic acid ethyl ester,unii-xuf0sq8l2j,p-toluic acid ethyl ester,xuf0sq8l2j,p-toluic acid, ethyl ester,4-methyl-benzoic acid ethyl ester,ethyl4-methylbenzoate PubChem CID: 66743 IUPAC Name: ethyl 4-methylbenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)C

PubChem CID 66743
CAS 94-08-6
Molecular Weight (g/mol) 164.204
MDL Number MFCD00009117
SMILES CCOC(=O)C1=CC=C(C=C1)C
Synonym ethyl p-toluate,ethyl p-methylbenzoate,benzoic acid, 4-methyl-, ethyl ester,4-methylbenzoic acid ethyl ester,unii-xuf0sq8l2j,p-toluic acid ethyl ester,xuf0sq8l2j,p-toluic acid, ethyl ester,4-methyl-benzoic acid ethyl ester,ethyl4-methylbenzoate
IUPAC Name ethyl 4-methylbenzoate
InChI Key NWPWRAWAUYIELB-UHFFFAOYSA-N
Molecular Formula C10H12O2
10,193

2,6-Dibromobenzaldehyde 98.0+%, TCI America™

CAS: 67713-23-9 Molecular Formula: C7H4Br2O Molecular Weight (g/mol): 263.92 MDL Number: MFCD11040410 InChI Key: YDYNSAUGVGAOLO-UHFFFAOYSA-N PubChem CID: 12648641 IUPAC Name: 2,6-dibromobenzaldehyde SMILES: BrC1=CC=CC(Br)=C1C=O

PubChem CID 12648641
CAS 67713-23-9
Molecular Weight (g/mol) 263.92
MDL Number MFCD11040410
SMILES BrC1=CC=CC(Br)=C1C=O
IUPAC Name 2,6-dibromobenzaldehyde
InChI Key YDYNSAUGVGAOLO-UHFFFAOYSA-N
Molecular Formula C7H4Br2O
10,194

Monobutyl Phthalate 95.0+%, TCI America™

CAS: 131-70-4 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00043498 InChI Key: YZBOVSFWWNVKRJ-UHFFFAOYSA-N Synonym: Phthalic Acid Monobutyl Ester, Butyl Hydrogen Phthalate PubChem CID: 8575 IUPAC Name: 2-(butoxycarbonyl)benzoic acid SMILES: CCCCOC(=O)C1=CC=CC=C1C(O)=O

PubChem CID 8575
CAS 131-70-4
Molecular Weight (g/mol) 222.24
MDL Number MFCD00043498
SMILES CCCCOC(=O)C1=CC=CC=C1C(O)=O
Synonym Phthalic Acid Monobutyl Ester, Butyl Hydrogen Phthalate
IUPAC Name 2-(butoxycarbonyl)benzoic acid
InChI Key YZBOVSFWWNVKRJ-UHFFFAOYSA-N
Molecular Formula C12H14O4
10,195

2-Formylbenzonitrile 99.0+%, TCI America™

CAS: 7468-67-9 Molecular Formula: C8H5NO Molecular Weight (g/mol): 131.13 MDL Number: MFCD00017503 InChI Key: QVTPWONEVZJCCS-UHFFFAOYSA-N Synonym: 2-cyanobenzaldehyde,o-cyanobenzaldehyde,benzonitrile, 2-formyl,cyanobenzaldehyde,2-formylbenzenecarbonitrile,2-cyano-benzaldehyde,2-formyl-benzonitrile,pubchem7409,#,acmc-1blgc PubChem CID: 101209 IUPAC Name: 2-formylbenzonitrile SMILES: O=CC1=CC=CC=C1C#N

PubChem CID 101209
CAS 7468-67-9
Molecular Weight (g/mol) 131.13
MDL Number MFCD00017503
SMILES O=CC1=CC=CC=C1C#N
Synonym 2-cyanobenzaldehyde,o-cyanobenzaldehyde,benzonitrile, 2-formyl,cyanobenzaldehyde,2-formylbenzenecarbonitrile,2-cyano-benzaldehyde,2-formyl-benzonitrile,pubchem7409,#,acmc-1blgc
IUPAC Name 2-formylbenzonitrile
InChI Key QVTPWONEVZJCCS-UHFFFAOYSA-N
Molecular Formula C8H5NO
10,196

4-Ethoxy-3-methoxybenzaldehyde 98.0+%, TCI America™

CAS: 120-25-2 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00016614 InChI Key: BERFDQAMXIBOHM-UHFFFAOYSA-N Synonym: 4-ethoxy-3-anisaldehyde,4-ethoxy-m-anisaldehyde,benzaldehyde, 4-ethoxy-3-methoxy,ethyl-vanillin,asischem n42243,4-ethoxy-3-methoxy-benzaldehyde,ethylvanillin?,4-ethoxyvanillin,vanillin ethyl ether,pubchem2648 PubChem CID: 67116 IUPAC Name: 4-ethoxy-3-methoxybenzaldehyde SMILES: CCOC1=C(C=C(C=C1)C=O)OC

PubChem CID 67116
CAS 120-25-2
Molecular Weight (g/mol) 180.203
MDL Number MFCD00016614
SMILES CCOC1=C(C=C(C=C1)C=O)OC
Synonym 4-ethoxy-3-anisaldehyde,4-ethoxy-m-anisaldehyde,benzaldehyde, 4-ethoxy-3-methoxy,ethyl-vanillin,asischem n42243,4-ethoxy-3-methoxy-benzaldehyde,ethylvanillin?,4-ethoxyvanillin,vanillin ethyl ether,pubchem2648
IUPAC Name 4-ethoxy-3-methoxybenzaldehyde
InChI Key BERFDQAMXIBOHM-UHFFFAOYSA-N
Molecular Formula C10H12O3
10,197

1,1,2,2-Tetrakis(4-methoxyphenyl)-1,2-ethanediol 96.0+%, TCI America™

CAS: 19920-00-4 Molecular Formula: C30H30O6 Molecular Weight (g/mol): 486.564 MDL Number: MFCD00185172 InChI Key: GJSYWZLTIIFQTD-UHFFFAOYSA-N Synonym: 1,1,2,2-Tetra-p-anisyl-1,2-ethanediol PubChem CID: 3456938 IUPAC Name: 1,1,2,2-tetrakis(4-methoxyphenyl)ethane-1,2-diol SMILES: COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)(C(C3=CC=C(C=C3)OC)(C4=CC=C(C=C4)OC)O)O

PubChem CID 3456938
CAS 19920-00-4
Molecular Weight (g/mol) 486.564
MDL Number MFCD00185172
SMILES COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)(C(C3=CC=C(C=C3)OC)(C4=CC=C(C=C4)OC)O)O
Synonym 1,1,2,2-Tetra-p-anisyl-1,2-ethanediol
IUPAC Name 1,1,2,2-tetrakis(4-methoxyphenyl)ethane-1,2-diol
InChI Key GJSYWZLTIIFQTD-UHFFFAOYSA-N
Molecular Formula C30H30O6
10,198

2,2'-Methylenebis[6-(1-methylcyclohexyl)-p-cresol] 95.0+%, TCI America™

CAS: 77-62-3 Molecular Formula: C29H40O2 Molecular Weight (g/mol): 420.64 MDL Number: MFCD00151797 InChI Key: PHXLONCQBNATSL-UHFFFAOYSA-N Synonym: 2,2'-methylenebis 6-1-methylcyclohexyl-p-cresol,ionox wsp,nonox wsp,bisalkofen mtsp,unii-7tir91vdi9,7tir91vdi9,p-cresol, 2,2'-methylenebis 6-1-methylcyclohexyl,2,2'-methylenebis 4-methyl-6-1-methylcyclohexyl phenol PubChem CID: 6486 IUPAC Name: 2-{[2-hydroxy-5-methyl-3-(1-methylcyclohexyl)phenyl]methyl}-4-methyl-6-(1-methylcyclohexyl)phenol SMILES: CC1=CC(=C(O)C(CC2=C(O)C(=CC(C)=C2)C2(C)CCCCC2)=C1)C1(C)CCCCC1

PubChem CID 6486
CAS 77-62-3
Molecular Weight (g/mol) 420.64
MDL Number MFCD00151797
SMILES CC1=CC(=C(O)C(CC2=C(O)C(=CC(C)=C2)C2(C)CCCCC2)=C1)C1(C)CCCCC1
Synonym 2,2'-methylenebis 6-1-methylcyclohexyl-p-cresol,ionox wsp,nonox wsp,bisalkofen mtsp,unii-7tir91vdi9,7tir91vdi9,p-cresol, 2,2'-methylenebis 6-1-methylcyclohexyl,2,2'-methylenebis 4-methyl-6-1-methylcyclohexyl phenol
IUPAC Name 2-{[2-hydroxy-5-methyl-3-(1-methylcyclohexyl)phenyl]methyl}-4-methyl-6-(1-methylcyclohexyl)phenol
InChI Key PHXLONCQBNATSL-UHFFFAOYSA-N
Molecular Formula C29H40O2
10,199

Bisacodyl 98.0+%, TCI America™

CAS: 603-50-9 Molecular Formula: C22H19NO4 Molecular Weight (g/mol): 361.40 MDL Number: MFCD00038039 InChI Key: KHOITXIGCFIULA-UHFFFAOYSA-N Synonym: bisacodyl,dulcolax,bicol,brocalax,durolax,dulcolan,endokolat,fenilaxan,hillcolax,sanvacual PubChem CID: 2391 IUPAC Name: 4-{[4-(acetyloxy)phenyl](pyridin-2-yl)methyl}phenyl acetate SMILES: CC(=O)OC1=CC=C(C=C1)C(C1=CC=C(OC(C)=O)C=C1)C1=CC=CC=N1

PubChem CID 2391
CAS 603-50-9
Molecular Weight (g/mol) 361.40
MDL Number MFCD00038039
SMILES CC(=O)OC1=CC=C(C=C1)C(C1=CC=C(OC(C)=O)C=C1)C1=CC=CC=N1
Synonym bisacodyl,dulcolax,bicol,brocalax,durolax,dulcolan,endokolat,fenilaxan,hillcolax,sanvacual
IUPAC Name 4-{[4-(acetyloxy)phenyl](pyridin-2-yl)methyl}phenyl acetate
InChI Key KHOITXIGCFIULA-UHFFFAOYSA-N
Molecular Formula C22H19NO4
10,200

4,4'-Isopropylidenediphenol Dimethacrylate 98.0+%, TCI America™

CAS: 3253-39-2 Molecular Formula: C23H24O4 Molecular Weight (g/mol): 364.44 MDL Number: MFCD00008585 InChI Key: QUZSUMLPWDHKCJ-UHFFFAOYSA-N Synonym: bisphenol a dimethacrylate,2,2-di 4-methacryloxyphenyl propane,4,4'-isopropylidenediphenol dimethacrylate,4,4'-isopropylidenediphenyl dimethacrylate,2-propenoic acid, 2-methyl-, 1-methylethylidene di-4,1-phenylene ester,propane-2,2-diylbis 4,1-phenylene bis 2-methylacrylate,4-2-4-2-methylprop-2-enoyloxy phenyl propan-2-yl phenyl 2-methylprop-2-enoate,bis-dma,2-propenoic acid, 2-methyl-, 1,1'-1-methylethylidene di-4,1-phenylene ester PubChem CID: 76739 ChEBI: CHEBI:34579 IUPAC Name: 4-(2-{4-[(2-methylprop-2-enoyl)oxy]phenyl}propan-2-yl)phenyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OC1=CC=C(C=C1)C(C)(C)C1=CC=C(OC(=O)C(C)=C)C=C1

PubChem CID 76739
CAS 3253-39-2
Molecular Weight (g/mol) 364.44
ChEBI CHEBI:34579
MDL Number MFCD00008585
SMILES CC(=C)C(=O)OC1=CC=C(C=C1)C(C)(C)C1=CC=C(OC(=O)C(C)=C)C=C1
Synonym bisphenol a dimethacrylate,2,2-di 4-methacryloxyphenyl propane,4,4'-isopropylidenediphenol dimethacrylate,4,4'-isopropylidenediphenyl dimethacrylate,2-propenoic acid, 2-methyl-, 1-methylethylidene di-4,1-phenylene ester,propane-2,2-diylbis 4,1-phenylene bis 2-methylacrylate,4-2-4-2-methylprop-2-enoyloxy phenyl propan-2-yl phenyl 2-methylprop-2-enoate,bis-dma,2-propenoic acid, 2-methyl-, 1,1'-1-methylethylidene di-4,1-phenylene ester
IUPAC Name 4-(2-{4-[(2-methylprop-2-enoyl)oxy]phenyl}propan-2-yl)phenyl 2-methylprop-2-enoate
InChI Key QUZSUMLPWDHKCJ-UHFFFAOYSA-N
Molecular Formula C23H24O4