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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 (129,837)
Phenols (24,890)
Naphthalenes (6,294)
Phenol esters (4,685)
Unsubstituted Phenols (1,453)
Fluorenes (1,282)
Thiophenols (748)
Anthracenes (509)
Indanes (489)
Phenanthrenes and derivatives (364)
Tetralins (340)
Pyrenes (281)
Triphenyl compounds (280)
Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (17)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (5)

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2,671 – 2,685 of 158,358 results
2,671
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m-Toluic acid, 99%

CAS: 99-04-7 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002523 InChI Key: GPSDUZXPYCFOSQ-UHFFFAOYSA-N Synonym: m-toluic acid,m-toluylic acid,3-toluic acid,benzoic acid, 3-methyl,meta-toluic acid,m-methylbenzoic acid,beta-methylbenzoic acid,3-methyl-benzoic acid,beta-bethylbenzoic acid,unii-1ua7k8eext PubChem CID: 7418 ChEBI: CHEBI:10589 IUPAC Name: 3-methylbenzoic acid SMILES: CC1=CC=CC(=C1)C(O)=O

PubChem CID 7418
CAS 99-04-7
Molecular Weight (g/mol) 136.15
ChEBI CHEBI:10589
MDL Number MFCD00002523
SMILES CC1=CC=CC(=C1)C(O)=O
Synonym m-toluic acid,m-toluylic acid,3-toluic acid,benzoic acid, 3-methyl,meta-toluic acid,m-methylbenzoic acid,beta-methylbenzoic acid,3-methyl-benzoic acid,beta-bethylbenzoic acid,unii-1ua7k8eext
IUPAC Name 3-methylbenzoic acid
InChI Key GPSDUZXPYCFOSQ-UHFFFAOYSA-N
Molecular Formula C8H8O2
2,672
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2-chloro-6-fluorobenzaldehyde, 95%

CAS: 387-45-1 Molecular Formula: C7H4ClFO Molecular Weight (g/mol): 158.56 MDL Number: MFCD00003306 InChI Key: OACPOWYLLGHGCR-UHFFFAOYSA-N Synonym: benzaldehyde, 2-chloro-6-fluoro,2,6-cfad,2-chloro-6-fluoro-benzaldehyd,unii-51yj9bw8w7,2-chloro-6-fluoro benzaldehyde,2-chloro-6-fluoro-benzaldehyde,2-fluoro-6-chloro benzaldehyde,6-chloro-2-fluorobenzaldehyde,pubchem1434,acmc-209j1r PubChem CID: 67847 IUPAC Name: 2-chloro-6-fluorobenzaldehyde SMILES: FC1=CC=CC(Cl)=C1C=O

PubChem CID 67847
CAS 387-45-1
Molecular Weight (g/mol) 158.56
MDL Number MFCD00003306
SMILES FC1=CC=CC(Cl)=C1C=O
Synonym benzaldehyde, 2-chloro-6-fluoro,2,6-cfad,2-chloro-6-fluoro-benzaldehyd,unii-51yj9bw8w7,2-chloro-6-fluoro benzaldehyde,2-chloro-6-fluoro-benzaldehyde,2-fluoro-6-chloro benzaldehyde,6-chloro-2-fluorobenzaldehyde,pubchem1434,acmc-209j1r
IUPAC Name 2-chloro-6-fluorobenzaldehyde
InChI Key OACPOWYLLGHGCR-UHFFFAOYSA-N
Molecular Formula C7H4ClFO
2,673
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Ethyl 3-aminobenzoate, 99+%

CAS: 582-33-2 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.19 MDL Number: MFCD00007794 InChI Key: ZMCBYSBVJIMENC-UHFFFAOYSA-N Synonym: 3-aminobenzoic acid ethyl ester,m-ethoxycarbonylaniline,3-ethoxycarbonyl aniline,ethyl m-aminobenzoate,benzoic acid, 3-amino-, ethyl ester,m-aminobenzoic acid, ethyl ester,m-aminobenzoate,metacaine,3-amino-benzoic acid ethyl ester,benzoic acid, m-amino-, ethyl ester PubChem CID: 11400 ChEBI: CHEBI:81494 IUPAC Name: ethyl 3-aminobenzoate SMILES: CCOC(=O)C1=CC(=CC=C1)N

PubChem CID 11400
CAS 582-33-2
Molecular Weight (g/mol) 165.19
ChEBI CHEBI:81494
MDL Number MFCD00007794
SMILES CCOC(=O)C1=CC(=CC=C1)N
Synonym 3-aminobenzoic acid ethyl ester,m-ethoxycarbonylaniline,3-ethoxycarbonyl aniline,ethyl m-aminobenzoate,benzoic acid, 3-amino-, ethyl ester,m-aminobenzoic acid, ethyl ester,m-aminobenzoate,metacaine,3-amino-benzoic acid ethyl ester,benzoic acid, m-amino-, ethyl ester
IUPAC Name ethyl 3-aminobenzoate
InChI Key ZMCBYSBVJIMENC-UHFFFAOYSA-N
Molecular Formula C9H11NO2
2,674
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Diallyl phthalate, 98%

CAS: 131-17-9 Molecular Formula: C14H14O4 Molecular Weight (g/mol): 246.26 MDL Number: MFCD00008646 InChI Key: QUDWYFHPNIMBFC-UHFFFAOYSA-N Synonym: diallyl phthalate,allyl phthalate,diallylphthalate,dapon r,phthalic acid diallyl ester,dapon 35,phthalic acid, diallyl ester,o-phthalic acid, diallyl ester,1,2-benzenedicarboxylic acid, di-2-propenyl ester,unii-f79l0ul6st PubChem CID: 8560 IUPAC Name: bis(prop-2-enyl) benzene-1,2-dicarboxylate SMILES: C=CCOC(=O)C1=CC=CC=C1C(=O)OCC=C

PubChem CID 8560
CAS 131-17-9
Molecular Weight (g/mol) 246.26
MDL Number MFCD00008646
SMILES C=CCOC(=O)C1=CC=CC=C1C(=O)OCC=C
Synonym diallyl phthalate,allyl phthalate,diallylphthalate,dapon r,phthalic acid diallyl ester,dapon 35,phthalic acid, diallyl ester,o-phthalic acid, diallyl ester,1,2-benzenedicarboxylic acid, di-2-propenyl ester,unii-f79l0ul6st
IUPAC Name bis(prop-2-enyl) benzene-1,2-dicarboxylate
InChI Key QUDWYFHPNIMBFC-UHFFFAOYSA-N
Molecular Formula C14H14O4
2,675
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Phenylglyoxylic acid, 98%

CAS: 611-73-4 Molecular Formula: C8H6O3 Molecular Weight (g/mol): 150.13 MDL Number: MFCD00002575 InChI Key: FAQJJMHZNSSFSM-UHFFFAOYSA-N Synonym: benzoylformic acid,phenylglyoxylic acid,oxophenylacetic acid,benzeneglyoxylic acid,phenylgloxylic acid,2-phenylethanoic acid,oxo phenyl acetic acid,benzoylformate,phenylglyoxalate,phenyloxoacetic acid PubChem CID: 11915 ChEBI: CHEBI:18280 IUPAC Name: 2-oxo-2-phenylacetic acid SMILES: OC(=O)C(=O)C1=CC=CC=C1

PubChem CID 11915
CAS 611-73-4
Molecular Weight (g/mol) 150.13
ChEBI CHEBI:18280
MDL Number MFCD00002575
SMILES OC(=O)C(=O)C1=CC=CC=C1
Synonym benzoylformic acid,phenylglyoxylic acid,oxophenylacetic acid,benzeneglyoxylic acid,phenylgloxylic acid,2-phenylethanoic acid,oxo phenyl acetic acid,benzoylformate,phenylglyoxalate,phenyloxoacetic acid
IUPAC Name 2-oxo-2-phenylacetic acid
InChI Key FAQJJMHZNSSFSM-UHFFFAOYSA-N
Molecular Formula C8H6O3
2,676
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4-Bromobenzaldehyde, 99%

CAS: 1122-91-4 Molecular Formula: C7H5BrO Molecular Weight (g/mol): 185.02 InChI Key: ZRYZBQLXDKPBDU-UHFFFAOYSA-N Synonym: p-bromobenzaldehyde,benzaldehyde, 4-bromo,benzaldehyde, p-bromo,4-bromo-benzaldehyde,4-bromo benzaldehyde,4-bromobenzylaldehyde,p-bromo benzaldehyde,unii-4l8vm24f65,4-brombenzaldehyde,4-brombenzaldehyd PubChem CID: 70741 IUPAC Name: 4-bromobenzaldehyde SMILES: C1=CC(=CC=C1C=O)Br

PubChem CID 70741
CAS 1122-91-4
Molecular Weight (g/mol) 185.02
SMILES C1=CC(=CC=C1C=O)Br
Synonym p-bromobenzaldehyde,benzaldehyde, 4-bromo,benzaldehyde, p-bromo,4-bromo-benzaldehyde,4-bromo benzaldehyde,4-bromobenzylaldehyde,p-bromo benzaldehyde,unii-4l8vm24f65,4-brombenzaldehyde,4-brombenzaldehyd
IUPAC Name 4-bromobenzaldehyde
InChI Key ZRYZBQLXDKPBDU-UHFFFAOYSA-N
Molecular Formula C7H5BrO
2,677
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4-Iodobenzaldehyde, 97+%

CAS: 15164-44-0 Molecular Formula: C7H5IO Molecular Weight (g/mol): 232.02 MDL Number: MFCD00039576 InChI Key: NIEBHDXUIJSHSL-UHFFFAOYSA-N Synonym: p-iodobenzaldehyde,benzaldehyde, 4-iodo,4-iodo-benzaldehyde,iodobenzenecarbaldehyde,4-iodo benzaldehyde,pubchem5349,acmc-1bpp9,intermediates-zcf02160,4-iodobenzaldehyde,ksc181a1r PubChem CID: 96657 IUPAC Name: 4-iodobenzaldehyde SMILES: IC1=CC=C(C=O)C=C1

PubChem CID 96657
CAS 15164-44-0
Molecular Weight (g/mol) 232.02
MDL Number MFCD00039576
SMILES IC1=CC=C(C=O)C=C1
Synonym p-iodobenzaldehyde,benzaldehyde, 4-iodo,4-iodo-benzaldehyde,iodobenzenecarbaldehyde,4-iodo benzaldehyde,pubchem5349,acmc-1bpp9,intermediates-zcf02160,4-iodobenzaldehyde,ksc181a1r
IUPAC Name 4-iodobenzaldehyde
InChI Key NIEBHDXUIJSHSL-UHFFFAOYSA-N
Molecular Formula C7H5IO
2,678
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3,5-Difluorobenzaldehyde, 98+%

CAS: 32085-88-4 Molecular Formula: C7H4F2O Molecular Weight (g/mol): 142.1 MDL Number: MFCD00010329 InChI Key: ASOFZHSTJHGQDT-UHFFFAOYSA-N Synonym: benzaldehyde, 3,5-difluoro,3,5-difluoro-benzaldehyde,pubchem1414,3,5difluorobenzaldehyde,acmc-1aewe,3,5-diflourobenzaldehyde,3-5-difluorobenzaldehyde,3, 5-difluorobenzaldehyde,ksc224o7p,3,5-difluorophenyl methanone PubChem CID: 588160 IUPAC Name: 3,5-difluorobenzaldehyde SMILES: C1=C(C=C(C=C1F)F)C=O

PubChem CID 588160
CAS 32085-88-4
Molecular Weight (g/mol) 142.1
MDL Number MFCD00010329
SMILES C1=C(C=C(C=C1F)F)C=O
Synonym benzaldehyde, 3,5-difluoro,3,5-difluoro-benzaldehyde,pubchem1414,3,5difluorobenzaldehyde,acmc-1aewe,3,5-diflourobenzaldehyde,3-5-difluorobenzaldehyde,3, 5-difluorobenzaldehyde,ksc224o7p,3,5-difluorophenyl methanone
IUPAC Name 3,5-difluorobenzaldehyde
InChI Key ASOFZHSTJHGQDT-UHFFFAOYSA-N
Molecular Formula C7H4F2O
2,679
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4-Fluorobenzaldehyde, 98+%, AcroSeal™

CAS: 459-57-4 Molecular Formula: C7H5FO Molecular Weight (g/mol): 124.11 MDL Number: MFCD00003378 InChI Key: UOQXIWFBQSVDPP-UHFFFAOYSA-N Synonym: p-fluorobenzaldehyde,benzaldehyde, 4-fluoro,4-fluoro-benzaldehyde,para-fluorobenzaldehyde,p-fluorbenzaldehyde,fluorobenzaldehyde 4-,benzaldehyde, p-fluoro,pfad,4-fluoro benzaldehyde,para fluoro benzaldehyde PubChem CID: 68023 IUPAC Name: 4-fluorobenzaldehyde SMILES: C1=CC(=CC=C1C=O)F

PubChem CID 68023
CAS 459-57-4
Molecular Weight (g/mol) 124.11
MDL Number MFCD00003378
SMILES C1=CC(=CC=C1C=O)F
Synonym p-fluorobenzaldehyde,benzaldehyde, 4-fluoro,4-fluoro-benzaldehyde,para-fluorobenzaldehyde,p-fluorbenzaldehyde,fluorobenzaldehyde 4-,benzaldehyde, p-fluoro,pfad,4-fluoro benzaldehyde,para fluoro benzaldehyde
IUPAC Name 4-fluorobenzaldehyde
InChI Key UOQXIWFBQSVDPP-UHFFFAOYSA-N
Molecular Formula C7H5FO
2,680

3-(1-Methyl-1H-pyrazol-3-yl)benzoic acid, 97%, Thermo Scientific™

CAS: 906352-85-0 Molecular Formula: C11H10N2O2 Molecular Weight (g/mol): 202.213 MDL Number: MFCD09065006 InChI Key: NQPMBEUYTBLTAG-UHFFFAOYSA-N Synonym: 3-1-methyl-1h-pyrazol-3-yl benzoic acid,3-1-methylpyrazol-3-yl benzoic acid,benzoicacid,3-1-methyl-1h-pyrazol-3-yl,3-3-carboxyphenyl-1-methyl-1h-pyrazole,benzoicacid, 3-1-methyl-1h-pyrazol-3-yl,benzoic acid, 3-1-methyl-1h-pyrazol-3-yl PubChem CID: 24229627 IUPAC Name: 3-(1-methylpyrazol-3-yl)benzoic acid SMILES: CN1C=CC(=N1)C2=CC(=CC=C2)C(=O)O

PubChem CID 24229627
CAS 906352-85-0
Molecular Weight (g/mol) 202.213
MDL Number MFCD09065006
SMILES CN1C=CC(=N1)C2=CC(=CC=C2)C(=O)O
Synonym 3-1-methyl-1h-pyrazol-3-yl benzoic acid,3-1-methylpyrazol-3-yl benzoic acid,benzoicacid,3-1-methyl-1h-pyrazol-3-yl,3-3-carboxyphenyl-1-methyl-1h-pyrazole,benzoicacid, 3-1-methyl-1h-pyrazol-3-yl,benzoic acid, 3-1-methyl-1h-pyrazol-3-yl
IUPAC Name 3-(1-methylpyrazol-3-yl)benzoic acid
InChI Key NQPMBEUYTBLTAG-UHFFFAOYSA-N
Molecular Formula C11H10N2O2
2,681
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Benzoic anhydride, 98%

CAS: 93-97-0 Molecular Formula: C14H10O3 Molecular Weight (g/mol): 226.23 MDL Number: MFCD00003073 InChI Key: CHIHQLCVLOXUJW-UHFFFAOYSA-N Synonym: benzoic anhydride,benzoic acid, anhydride,benzoyl anhydride,benzoylbenzoate,benzoic acid anhydride,benzoic acid, 1,1'-anhydride,phenyl anhydride,benzoesaeureanhydrid,unii-9k7x34fov2,phenylcarbonyl benzoate PubChem CID: 7167 ChEBI: CHEBI:38815 IUPAC Name: benzoyl benzoate SMILES: C1=CC=C(C=C1)C(=O)OC(=O)C2=CC=CC=C2

PubChem CID 7167
CAS 93-97-0
Molecular Weight (g/mol) 226.23
ChEBI CHEBI:38815
MDL Number MFCD00003073
SMILES C1=CC=C(C=C1)C(=O)OC(=O)C2=CC=CC=C2
Synonym benzoic anhydride,benzoic acid, anhydride,benzoyl anhydride,benzoylbenzoate,benzoic acid anhydride,benzoic acid, 1,1'-anhydride,phenyl anhydride,benzoesaeureanhydrid,unii-9k7x34fov2,phenylcarbonyl benzoate
IUPAC Name benzoyl benzoate
InChI Key CHIHQLCVLOXUJW-UHFFFAOYSA-N
Molecular Formula C14H10O3
2,682
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Benzoyl isothiocyanate, 98%

CAS: 532-55-8 Molecular Formula: C8H5NOS Molecular Weight (g/mol): 163.2 MDL Number: MFCD00004815 InChI Key: CPEKAXYCDKETEN-UHFFFAOYSA-N Synonym: benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone PubChem CID: 68284 IUPAC Name: benzoyl isothiocyanate SMILES: C1=CC=C(C=C1)C(=O)N=C=S

PubChem CID 68284
CAS 532-55-8
Molecular Weight (g/mol) 163.2
MDL Number MFCD00004815
SMILES C1=CC=C(C=C1)C(=O)N=C=S
Synonym benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone
IUPAC Name benzoyl isothiocyanate
InChI Key CPEKAXYCDKETEN-UHFFFAOYSA-N
Molecular Formula C8H5NOS
2,683
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2,3,6-Trifluorobenzaldehyde, 97%, Thermo Scientific™

CAS: 104451-70-9 Molecular Formula: C7H3F3O Molecular Weight (g/mol): 160.10 MDL Number: MFCD00061195 InChI Key: XSBAHBVACIKRTG-UHFFFAOYSA-N Synonym: benzaldehyde, 2,3,6-trifluoro,2,3,6-trifluoro-benzaldehyde,pubchem1467,acmc-1bqm6,2,3,6-trifluorobenzoaldehyde,ksc494g2t,2,3,6-trifluoro benzaldehyde,timtec-bb sbb003970,attercop-chm at111497 PubChem CID: 517845 IUPAC Name: 2,3,6-trifluorobenzaldehyde SMILES: FC1=CC=C(F)C(C=O)=C1F

PubChem CID 517845
CAS 104451-70-9
Molecular Weight (g/mol) 160.10
MDL Number MFCD00061195
SMILES FC1=CC=C(F)C(C=O)=C1F
Synonym benzaldehyde, 2,3,6-trifluoro,2,3,6-trifluoro-benzaldehyde,pubchem1467,acmc-1bqm6,2,3,6-trifluorobenzoaldehyde,ksc494g2t,2,3,6-trifluoro benzaldehyde,timtec-bb sbb003970,attercop-chm at111497
IUPAC Name 2,3,6-trifluorobenzaldehyde
InChI Key XSBAHBVACIKRTG-UHFFFAOYSA-N
Molecular Formula C7H3F3O
2,684
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4-Iodobenzaldehyde, 98+%

CAS: 15164-44-0 Molecular Formula: C7H5IO Molecular Weight (g/mol): 232.02 MDL Number: MFCD00039576 InChI Key: NIEBHDXUIJSHSL-UHFFFAOYSA-N Synonym: p-iodobenzaldehyde,benzaldehyde, 4-iodo,4-iodo-benzaldehyde,iodobenzenecarbaldehyde,4-iodo benzaldehyde,pubchem5349,acmc-1bpp9,intermediates-zcf02160,4-iodobenzaldehyde,ksc181a1r PubChem CID: 96657 IUPAC Name: 4-iodobenzaldehyde SMILES: IC1=CC=C(C=O)C=C1

PubChem CID 96657
CAS 15164-44-0
Molecular Weight (g/mol) 232.02
MDL Number MFCD00039576
SMILES IC1=CC=C(C=O)C=C1
Synonym p-iodobenzaldehyde,benzaldehyde, 4-iodo,4-iodo-benzaldehyde,iodobenzenecarbaldehyde,4-iodo benzaldehyde,pubchem5349,acmc-1bpp9,intermediates-zcf02160,4-iodobenzaldehyde,ksc181a1r
IUPAC Name 4-iodobenzaldehyde
InChI Key NIEBHDXUIJSHSL-UHFFFAOYSA-N
Molecular Formula C7H5IO
2,685
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2-Bromo-5-chlorobenzaldehyde, 97%

CAS: 174265-12-4 Molecular Formula: C7H4BrClO Molecular Weight (g/mol): 219.462 MDL Number: MFCD00462870 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
MDL Number MFCD00462870
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