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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 (67,618)
Phenols (13,422)
Naphthalenes (5,064)
Fluorenes (1,235)
Unsubstituted Phenols (1,165)
Thiophenols (617)
Phenol esters (559)
Anthracenes (413)
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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6,376 – 6,390 of 78,434 results
6,376

2,4,6-Trifluorobenzaldehyde 98.0+%, TCI America™

CAS: 58551-83-0 Molecular Formula: C7H3F3O Molecular Weight (g/mol): 160.095 MDL Number: MFCD00061197 InChI Key: KPJIEPBITZLHPQ-UHFFFAOYSA-N Synonym: benzaldehyde, 2,4,6-trifluoro,2,4,6-ttrifluorobenzaldehyde,pubchem1416,acmc-209m5d,2,4,6 trifluorobenzaldehyde,ksc272c8l,2,4,6-trifluoro benzaldehyde,2,4,6-trifluoro-benzaldehyde PubChem CID: 521845 IUPAC Name: 2,4,6-trifluorobenzaldehyde SMILES: C1=C(C=C(C(=C1F)C=O)F)F

PubChem CID 521845
CAS 58551-83-0
Molecular Weight (g/mol) 160.095
MDL Number MFCD00061197
SMILES C1=C(C=C(C(=C1F)C=O)F)F
Synonym benzaldehyde, 2,4,6-trifluoro,2,4,6-ttrifluorobenzaldehyde,pubchem1416,acmc-209m5d,2,4,6 trifluorobenzaldehyde,ksc272c8l,2,4,6-trifluoro benzaldehyde,2,4,6-trifluoro-benzaldehyde
IUPAC Name 2,4,6-trifluorobenzaldehyde
InChI Key KPJIEPBITZLHPQ-UHFFFAOYSA-N
Molecular Formula C7H3F3O
6,377

4-(2,5-Dioxotetrahydrofuran-3-yl)-1,2,3,4-tetrahydronaphthalene-1,2-dicarboxylic Anhydride 97.0+%, TCI America™

CAS: 13912-65-7 Molecular Formula: C16H12O6 Molecular Weight (g/mol): 300.266 MDL Number: MFCD00030105 InChI Key: JYCTWJFSRDBYJX-UHFFFAOYSA-N Synonym: 4-(2,5-Dioxotetrahydrofuran-3-yl)-tetralin-1,2-dicarboxylic Anhydride PubChem CID: 85657 IUPAC Name: 5-(2,5-dioxooxolan-3-yl)-3a,4,5,9b-tetrahydrobenzo[e][2]benzofuran-1,3-dione SMILES: C1C(C2=CC=CC=C2C3C1C(=O)OC3=O)C4CC(=O)OC4=O

PubChem CID 85657
CAS 13912-65-7
Molecular Weight (g/mol) 300.266
MDL Number MFCD00030105
SMILES C1C(C2=CC=CC=C2C3C1C(=O)OC3=O)C4CC(=O)OC4=O
Synonym 4-(2,5-Dioxotetrahydrofuran-3-yl)-tetralin-1,2-dicarboxylic Anhydride
IUPAC Name 5-(2,5-dioxooxolan-3-yl)-3a,4,5,9b-tetrahydrobenzo[e][2]benzofuran-1,3-dione
InChI Key JYCTWJFSRDBYJX-UHFFFAOYSA-N
Molecular Formula C16H12O6
6,378

5-Isopropyl-m-xylene 85.0+%, TCI America™

CAS: 4706-90-5 Molecular Formula: C11H16 Molecular Weight (g/mol): 148.25 MDL Number: MFCD00026405 InChI Key: RMKJTYPFCFNTGQ-UHFFFAOYSA-N Synonym: 3,5-Dimethylcumene, 3,5-Dimethylisopropylbenzene PubChem CID: 20833 IUPAC Name: 1,3-dimethyl-5-(propan-2-yl)benzene SMILES: CC(C)C1=CC(C)=CC(C)=C1

PubChem CID 20833
CAS 4706-90-5
Molecular Weight (g/mol) 148.25
MDL Number MFCD00026405
SMILES CC(C)C1=CC(C)=CC(C)=C1
Synonym 3,5-Dimethylcumene, 3,5-Dimethylisopropylbenzene
IUPAC Name 1,3-dimethyl-5-(propan-2-yl)benzene
InChI Key RMKJTYPFCFNTGQ-UHFFFAOYSA-N
Molecular Formula C11H16
6,379

(Formylmethyl)triphenylphosphonium Chloride 98.0+%, TCI America™

CAS: 62942-43-2 Molecular Formula: C20H18ClOP Molecular Weight (g/mol): 340.79 MDL Number: MFCD00012003 InChI Key: RVEJRPJGKXTQIF-UHFFFAOYSA-M Synonym: formylmethyl triphenylphosphonium chloride,2-oxoethyl triphenylphosphonium chloride,2-triphenylphosphino ethanal, chloride,2-oxoethyl triphenylphosphanium chloride,acmc-1b4xm,2-oxoethyltriphenylphosphonium chloride,formylmethyl triphenylphosphoniumchloride,2-oxoethyl triphenyl phosphanium chloride,2-oxoethyl triphenyl phosphonium chloride PubChem CID: 2733863 IUPAC Name: (2-oxoethyl)triphenylphosphanium chloride SMILES: [Cl-].O=CC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 2733863
CAS 62942-43-2
Molecular Weight (g/mol) 340.79
MDL Number MFCD00012003
SMILES [Cl-].O=CC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym formylmethyl triphenylphosphonium chloride,2-oxoethyl triphenylphosphonium chloride,2-triphenylphosphino ethanal, chloride,2-oxoethyl triphenylphosphanium chloride,acmc-1b4xm,2-oxoethyltriphenylphosphonium chloride,formylmethyl triphenylphosphoniumchloride,2-oxoethyl triphenyl phosphanium chloride,2-oxoethyl triphenyl phosphonium chloride
IUPAC Name (2-oxoethyl)triphenylphosphanium chloride
InChI Key RVEJRPJGKXTQIF-UHFFFAOYSA-M
Molecular Formula C20H18ClOP
6,380

3-Bromo-5-chlorobenzonitrile 98.0+%, TCI America™

CAS: 304854-55-5 Molecular Formula: C7H3BrClN Molecular Weight (g/mol): 216.462 MDL Number: MFCD06200840 InChI Key: DRKWKPSNVQVDKZ-UHFFFAOYSA-N PubChem CID: 15965893 IUPAC Name: 3-bromo-5-chlorobenzonitrile SMILES: C1=C(C=C(C=C1Cl)Br)C#N

PubChem CID 15965893
CAS 304854-55-5
Molecular Weight (g/mol) 216.462
MDL Number MFCD06200840
SMILES C1=C(C=C(C=C1Cl)Br)C#N
IUPAC Name 3-bromo-5-chlorobenzonitrile
InChI Key DRKWKPSNVQVDKZ-UHFFFAOYSA-N
Molecular Formula C7H3BrClN
6,381

3,4-Dinitrobenzoic Acid 98.0+%, TCI America™

CAS: 528-45-0 Molecular Formula: C7H4N2O6 Molecular Weight (g/mol): 212.12 MDL Number: MFCD00007255 InChI Key: OMVRRHJJQILIJX-UHFFFAOYSA-N Synonym: 3,4-dinitrobenzoic acid,benzoic acid, 3,4-dinitro,unii-0l3n4t0gpd,ccris 3128,3,4-dinitrobenzioc acid,0l3n4t0gpd,3,4-dinitrobenzoate,3,4-di-nitro-benzoic acid,zlchem 522,pubchem4956 PubChem CID: 10709 IUPAC Name: 3,4-dinitrobenzoic acid SMILES: OC(=O)C1=CC=C(C(=C1)[N+]([O-])=O)[N+]([O-])=O

PubChem CID 10709
CAS 528-45-0
Molecular Weight (g/mol) 212.12
MDL Number MFCD00007255
SMILES OC(=O)C1=CC=C(C(=C1)[N+]([O-])=O)[N+]([O-])=O
Synonym 3,4-dinitrobenzoic acid,benzoic acid, 3,4-dinitro,unii-0l3n4t0gpd,ccris 3128,3,4-dinitrobenzioc acid,0l3n4t0gpd,3,4-dinitrobenzoate,3,4-di-nitro-benzoic acid,zlchem 522,pubchem4956
IUPAC Name 3,4-dinitrobenzoic acid
InChI Key OMVRRHJJQILIJX-UHFFFAOYSA-N
Molecular Formula C7H4N2O6
6,382

N-Methyl-p-toluidine 97.0+%, TCI America™

CAS: 623-08-5 Molecular Formula: C8H11N Molecular Weight (g/mol): 121.18 MDL Number: MFCD00025628 InChI Key: QCIFLGSATTWUQJ-UHFFFAOYSA-N Synonym: N,4-Dimethylaniline, 4-(Methylamino)toluene PubChem CID: 12165 IUPAC Name: N,4-dimethylaniline SMILES: CNC1=CC=C(C)C=C1

PubChem CID 12165
CAS 623-08-5
Molecular Weight (g/mol) 121.18
MDL Number MFCD00025628
SMILES CNC1=CC=C(C)C=C1
Synonym N,4-Dimethylaniline, 4-(Methylamino)toluene
IUPAC Name N,4-dimethylaniline
InChI Key QCIFLGSATTWUQJ-UHFFFAOYSA-N
Molecular Formula C8H11N
6,383

9,9-Bis(4-amino-3-fluorophenyl)fluorene 98.0+%, TCI America™

CAS: 127926-65-2 Molecular Formula: C25H18F2N2 Molecular Weight (g/mol): 384.43 InChI Key: RXNKCIBVUNMMAD-UHFFFAOYSA-N Synonym: 2,2′C-Difluoro-4,4′C-(9-fluorenylidene)dianiline PubChem CID: 44629774 IUPAC Name: 4-[9-(4-amino-3-fluorophenyl)fluoren-9-yl]-2-fluoroaniline SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C2(C4=CC(=C(C=C4)N)F)C5=CC(=C(C=C5)N)F

PubChem CID 44629774
CAS 127926-65-2
Molecular Weight (g/mol) 384.43
SMILES C1=CC=C2C(=C1)C3=CC=CC=C3C2(C4=CC(=C(C=C4)N)F)C5=CC(=C(C=C5)N)F
Synonym 2,2′C-Difluoro-4,4′C-(9-fluorenylidene)dianiline
IUPAC Name 4-[9-(4-amino-3-fluorophenyl)fluoren-9-yl]-2-fluoroaniline
InChI Key RXNKCIBVUNMMAD-UHFFFAOYSA-N
Molecular Formula C25H18F2N2
6,384

3,4'-Diamino-4-nitrodiphenyl Ether 98.0+%, TCI America™

CAS: 30491-74-8 Molecular Formula: C12H11N3O3 Molecular Weight (g/mol): 245.24 MDL Number: MFCD15072156 InChI Key: ZHELWQKSRPWTPN-UHFFFAOYSA-N PubChem CID: 13705242 IUPAC Name: 5-(4-aminophenoxy)-2-nitroaniline SMILES: NC1=CC=C(OC2=CC(N)=C(C=C2)[N+]([O-])=O)C=C1

PubChem CID 13705242
CAS 30491-74-8
Molecular Weight (g/mol) 245.24
MDL Number MFCD15072156
SMILES NC1=CC=C(OC2=CC(N)=C(C=C2)[N+]([O-])=O)C=C1
IUPAC Name 5-(4-aminophenoxy)-2-nitroaniline
InChI Key ZHELWQKSRPWTPN-UHFFFAOYSA-N
Molecular Formula C12H11N3O3
6,385

4-Chloro-4'-hydroxybiphenyl 98.0+%, TCI America™

CAS: 28034-99-3 Molecular Formula: C12H9ClO Molecular Weight (g/mol): 204.653 MDL Number: MFCD00143298 InChI Key: ICVFJPSNAUMFCW-UHFFFAOYSA-N Synonym: 4-chloro-4'-hydroxybiphenyl,4-chloro-4'-biphenylol,4'-chlorobiphenyl-4-ol,4-4-chlorophenyl phenol,4-chloro-4-hydroxybiphenyl,4-biphenylol, 4'-chloro,unii-in91367n9r,1,1'-biphenyl-4-ol, 4'-chloro,4'-chloro-4-biphenylol,4'-chloro-1,1'-biphenyl-4-ol PubChem CID: 91589 ChEBI: CHEBI:34394 IUPAC Name: 4-(4-chlorophenyl)phenol SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)Cl)O

PubChem CID 91589
CAS 28034-99-3
Molecular Weight (g/mol) 204.653
ChEBI CHEBI:34394
MDL Number MFCD00143298
SMILES C1=CC(=CC=C1C2=CC=C(C=C2)Cl)O
Synonym 4-chloro-4'-hydroxybiphenyl,4-chloro-4'-biphenylol,4'-chlorobiphenyl-4-ol,4-4-chlorophenyl phenol,4-chloro-4-hydroxybiphenyl,4-biphenylol, 4'-chloro,unii-in91367n9r,1,1'-biphenyl-4-ol, 4'-chloro,4'-chloro-4-biphenylol,4'-chloro-1,1'-biphenyl-4-ol
IUPAC Name 4-(4-chlorophenyl)phenol
InChI Key ICVFJPSNAUMFCW-UHFFFAOYSA-N
Molecular Formula C12H9ClO
6,386

(R)-(-)-1,2,3,4-Tetrahydro-1-naphthol 98.0+%, TCI America™

CAS: 23357-45-1 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.205 MDL Number: MFCD00063005 InChI Key: JAAJQSRLGAYGKZ-SNVBAGLBSA-N Synonym: (R)-(-)-alpha-Tetralol PubChem CID: 7058028 IUPAC Name: (1R)-1,2,3,4-tetrahydronaphthalen-1-ol SMILES: C1CC(C2=CC=CC=C2C1)O

PubChem CID 7058028
CAS 23357-45-1
Molecular Weight (g/mol) 148.205
MDL Number MFCD00063005
SMILES C1CC(C2=CC=CC=C2C1)O
Synonym (R)-(-)-alpha-Tetralol
IUPAC Name (1R)-1,2,3,4-tetrahydronaphthalen-1-ol
InChI Key JAAJQSRLGAYGKZ-SNVBAGLBSA-N
Molecular Formula C10H12O
6,387

1-[(2-Propynyloxy)methyl]pyrene 98.0+%, TCI America™

CAS: 1115084-83-7 Molecular Formula: C20H14O Molecular Weight (g/mol): 270.331 InChI Key: PHLBHJYVJNAPAY-UHFFFAOYSA-N Synonym: 1-[(Propargyloxy)methyl]pyrene PubChem CID: 91972178 IUPAC Name: 1-(prop-2-ynoxymethyl)pyrene SMILES: C#CCOCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

PubChem CID 91972178
CAS 1115084-83-7
Molecular Weight (g/mol) 270.331
SMILES C#CCOCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1
Synonym 1-[(Propargyloxy)methyl]pyrene
IUPAC Name 1-(prop-2-ynoxymethyl)pyrene
InChI Key PHLBHJYVJNAPAY-UHFFFAOYSA-N
Molecular Formula C20H14O
6,388

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

CAS: 88038-94-2 Molecular Formula: C16H16O2 Molecular Weight (g/mol): 240.302 MDL Number: MFCD00017335 InChI Key: HCPBURTZSXRGBN-UHFFFAOYSA-N Synonym: 4-4-propylphenyl benzoic acid,4-4-n-propylphenyl benzoic acid,4'-propyl-1,1'-biphenyl-4-carboxylic acid,4-propylbiphenyl-4'-carboxylic acid,4-propyl-4'-biphenylcarboxylic acid,4'-propylbiphenyl-4-carboxylic acid,4-n-propylbiphenyl-4'-carboxylic acid,4-p-n-propylphenyl benzoic acid,1,1'-biphenyl-4-carboxylic acid, 4'-propyl,4'-n-propylbiphenyl-4-carboxylic acid PubChem CID: 522891 IUPAC Name: 4-(4-propylphenyl)benzoic acid SMILES: CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

PubChem CID 522891
CAS 88038-94-2
Molecular Weight (g/mol) 240.302
MDL Number MFCD00017335
SMILES CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
Synonym 4-4-propylphenyl benzoic acid,4-4-n-propylphenyl benzoic acid,4'-propyl-1,1'-biphenyl-4-carboxylic acid,4-propylbiphenyl-4'-carboxylic acid,4-propyl-4'-biphenylcarboxylic acid,4'-propylbiphenyl-4-carboxylic acid,4-n-propylbiphenyl-4'-carboxylic acid,4-p-n-propylphenyl benzoic acid,1,1'-biphenyl-4-carboxylic acid, 4'-propyl,4'-n-propylbiphenyl-4-carboxylic acid
IUPAC Name 4-(4-propylphenyl)benzoic acid
InChI Key HCPBURTZSXRGBN-UHFFFAOYSA-N
Molecular Formula C16H16O2
6,389

4-(Trifluoromethoxy)anisole 97.0+%, TCI America™

CAS: 710-18-9 Molecular Formula: C8H7F3O2 Molecular Weight (g/mol): 192.137 MDL Number: MFCD00216942 InChI Key: NOAFZIOGGDPYKK-UHFFFAOYSA-N Synonym: 4-trifluoromethoxy anisole,1-methoxy-4-trifluoromethoxy benzene,p-trifluoromethoxy anisole,4-trifluoromethoxyanisole,benzene, 1-methoxy-4-trifluoromethoxy,4-methoxy trifluoromethoxy benzene,hydroquinone methyl trifluoromethyl ether,trifluoro 4-methoxyphenoxy methane,pubchem3570,acmc-1bcz3 PubChem CID: 2724973 IUPAC Name: 1-methoxy-4-(trifluoromethoxy)benzene SMILES: COC1=CC=C(C=C1)OC(F)(F)F

PubChem CID 2724973
CAS 710-18-9
Molecular Weight (g/mol) 192.137
MDL Number MFCD00216942
SMILES COC1=CC=C(C=C1)OC(F)(F)F
Synonym 4-trifluoromethoxy anisole,1-methoxy-4-trifluoromethoxy benzene,p-trifluoromethoxy anisole,4-trifluoromethoxyanisole,benzene, 1-methoxy-4-trifluoromethoxy,4-methoxy trifluoromethoxy benzene,hydroquinone methyl trifluoromethyl ether,trifluoro 4-methoxyphenoxy methane,pubchem3570,acmc-1bcz3
IUPAC Name 1-methoxy-4-(trifluoromethoxy)benzene
InChI Key NOAFZIOGGDPYKK-UHFFFAOYSA-N
Molecular Formula C8H7F3O2
6,390

Methyl 5-Hydroxyanthranilate 98.0+%, TCI America™

CAS: 1882-72-0 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.16 MDL Number: MFCD05863263 InChI Key: DWBKSTKVIIRFHL-UHFFFAOYSA-N Synonym: 5-Hydroxyanthranilic Acid Methyl Ester, Methyl 2-Amino-5-hydroxybenzoate, 2-Amino-5-hydroxybenzoic Acid Methyl Ester PubChem CID: 819940 IUPAC Name: methyl 2-amino-5-hydroxybenzoate SMILES: COC(=O)C1=C(N)C=CC(O)=C1

PubChem CID 819940
CAS 1882-72-0
Molecular Weight (g/mol) 167.16
MDL Number MFCD05863263
SMILES COC(=O)C1=C(N)C=CC(O)=C1
Synonym 5-Hydroxyanthranilic Acid Methyl Ester, Methyl 2-Amino-5-hydroxybenzoate, 2-Amino-5-hydroxybenzoic Acid Methyl Ester
IUPAC Name methyl 2-amino-5-hydroxybenzoate
InChI Key DWBKSTKVIIRFHL-UHFFFAOYSA-N
Molecular Formula C8H9NO3