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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 (129,838)
Phenols (24,890)
Naphthalenes (6,293)
Phenol esters (4,684)
Unsubstituted Phenols (1,453)
Fluorenes (1,297)
Thiophenols (748)
Anthracenes (509)
Indanes (489)
Phenanthrenes and derivatives (364)
Tetralins (340)
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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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6,226 – 6,240 of 158,371 results
6,226

p-Anisaldehyde Dimethyl Acetal 97.0+%, TCI America™

CAS: 2186-92-7 Molecular Formula: C10H14O3 Molecular Weight (g/mol): 182.22 MDL Number: MFCD00036507 InChI Key: NNHYAHOTXLASEA-UHFFFAOYSA-N Synonym: 1-dimethoxymethyl-4-methoxybenzene,p-anisaldehyde dimethyl acetal,anisaldehyde dimethyl acetal,4-methoxybenzaldehyde dimethyl acetal,p-dimethoxymethyl anisole,benzene, 1-dimethoxymethyl-4-methoxy,p-anisaldehydedimethylacetal,unii-xte77a5et4,anisicaldehyde dimethylacetal,p-anisaldehyde dimethylacetal PubChem CID: 75140 IUPAC Name: 1-(dimethoxymethyl)-4-methoxybenzene SMILES: COC(OC)C1=CC=C(OC)C=C1

PubChem CID 75140
CAS 2186-92-7
Molecular Weight (g/mol) 182.22
MDL Number MFCD00036507
SMILES COC(OC)C1=CC=C(OC)C=C1
Synonym 1-dimethoxymethyl-4-methoxybenzene,p-anisaldehyde dimethyl acetal,anisaldehyde dimethyl acetal,4-methoxybenzaldehyde dimethyl acetal,p-dimethoxymethyl anisole,benzene, 1-dimethoxymethyl-4-methoxy,p-anisaldehydedimethylacetal,unii-xte77a5et4,anisicaldehyde dimethylacetal,p-anisaldehyde dimethylacetal
IUPAC Name 1-(dimethoxymethyl)-4-methoxybenzene
InChI Key NNHYAHOTXLASEA-UHFFFAOYSA-N
Molecular Formula C10H14O3
6,227

1-Bromo-2,4,5-trifluorobenzene 98.0+%, TCI America™

CAS: 327-52-6 Molecular Formula: C6H2BrF3 Molecular Weight (g/mol): 210.981 MDL Number: MFCD00000306 InChI Key: DVTULTINXNWGJY-UHFFFAOYSA-N Synonym: 2,4,5-trifluorobromobenzene,2-bromo-1,4,5-trifluorobenzene,benzene, 1-bromo-2,4,5-trifluoro,1-bromo-2,4,5-trifluoro-benzene,paragos 390205,5-bromo-1,2,4-trifluorobenzene,fr bf df ee,pubchem2306,acmc-1cs6j,ksc224g3h PubChem CID: 67597 IUPAC Name: 1-bromo-2,4,5-trifluorobenzene SMILES: C1=C(C(=CC(=C1F)Br)F)F

PubChem CID 67597
CAS 327-52-6
Molecular Weight (g/mol) 210.981
MDL Number MFCD00000306
SMILES C1=C(C(=CC(=C1F)Br)F)F
Synonym 2,4,5-trifluorobromobenzene,2-bromo-1,4,5-trifluorobenzene,benzene, 1-bromo-2,4,5-trifluoro,1-bromo-2,4,5-trifluoro-benzene,paragos 390205,5-bromo-1,2,4-trifluorobenzene,fr bf df ee,pubchem2306,acmc-1cs6j,ksc224g3h
IUPAC Name 1-bromo-2,4,5-trifluorobenzene
InChI Key DVTULTINXNWGJY-UHFFFAOYSA-N
Molecular Formula C6H2BrF3
6,228

4-(1,1,3,3-Tetramethylbutyl)phenol 95.0+%, TCI America™

CAS: 140-66-9 Molecular Formula: C14H22O Molecular Weight (g/mol): 206.329 MDL Number: MFCD00002368 InChI Key: ISAVYTVYFVQUDY-UHFFFAOYSA-N Synonym: 4-tert-octylphenol,p-tert-octylphenol,4-t-octylphenol,4-1,1,3,3-tetramethylbutyl phenol,4-2,4,4-trimethylpentan-2-yl phenol,p-terc.oktylfenol,para-tert-octylphenol,p-1,1,3,3-tetramethylbutyl phenol,phenol, 4-1,1,3,3-tetramethylbutyl,phenol, p-tert-octyl PubChem CID: 8814 ChEBI: CHEBI:34445 IUPAC Name: 4-(2,4,4-trimethylpentan-2-yl)phenol SMILES: CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O

PubChem CID 8814
CAS 140-66-9
Molecular Weight (g/mol) 206.329
ChEBI CHEBI:34445
MDL Number MFCD00002368
SMILES CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O
Synonym 4-tert-octylphenol,p-tert-octylphenol,4-t-octylphenol,4-1,1,3,3-tetramethylbutyl phenol,4-2,4,4-trimethylpentan-2-yl phenol,p-terc.oktylfenol,para-tert-octylphenol,p-1,1,3,3-tetramethylbutyl phenol,phenol, 4-1,1,3,3-tetramethylbutyl,phenol, p-tert-octyl
IUPAC Name 4-(2,4,4-trimethylpentan-2-yl)phenol
InChI Key ISAVYTVYFVQUDY-UHFFFAOYSA-N
Molecular Formula C14H22O
6,229

Benzoic Acid 99.0+%, TCI America™

CAS: 65-85-0 Molecular Formula: C7H6O2 Molecular Weight (g/mol): 122.123 MDL Number: MFCD00002398 InChI Key: WPYMKLBDIGXBTP-UHFFFAOYSA-N Synonym: benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv PubChem CID: 243 ChEBI: CHEBI:30746 IUPAC Name: benzoic acid SMILES: C1=CC=C(C=C1)C(=O)O

PubChem CID 243
CAS 65-85-0
Molecular Weight (g/mol) 122.123
ChEBI CHEBI:30746
MDL Number MFCD00002398
SMILES C1=CC=C(C=C1)C(=O)O
Synonym benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv
IUPAC Name benzoic acid
InChI Key WPYMKLBDIGXBTP-UHFFFAOYSA-N
Molecular Formula C7H6O2
6,230

4-Methyl-N-tosylbenzenesulfonamide 98.0+%, TCI America™

CAS: 3695-00-9 Molecular Formula: C14H15NO4S2 Molecular Weight (g/mol): 325.397 MDL Number: MFCD00014917 InChI Key: LHWZLUXODWUHLZ-UHFFFAOYSA-N Synonym: bis p-tolylsulfonyl amine,di-p-toluenesulfonamide,ditosylamine,di-p-toluenesulfonimide,bis 4-methylbenzenesulfon amine,benzenesulfonamide, 4-methyl-n-4-methylphenyl sulfonyl,4-methyl-n-tosylbenzenesulfonamide,4-methyl-n-4-methylphenyl sulfonyl benzenesulfonamide PubChem CID: 77279 IUPAC Name: 4-methyl-N-(4-methylphenyl)sulfonylbenzenesulfonamide SMILES: CC1=CC=C(C=C1)S(=O)(=O)NS(=O)(=O)C2=CC=C(C=C2)C

PubChem CID 77279
CAS 3695-00-9
Molecular Weight (g/mol) 325.397
MDL Number MFCD00014917
SMILES CC1=CC=C(C=C1)S(=O)(=O)NS(=O)(=O)C2=CC=C(C=C2)C
Synonym bis p-tolylsulfonyl amine,di-p-toluenesulfonamide,ditosylamine,di-p-toluenesulfonimide,bis 4-methylbenzenesulfon amine,benzenesulfonamide, 4-methyl-n-4-methylphenyl sulfonyl,4-methyl-n-tosylbenzenesulfonamide,4-methyl-n-4-methylphenyl sulfonyl benzenesulfonamide
IUPAC Name 4-methyl-N-(4-methylphenyl)sulfonylbenzenesulfonamide
InChI Key LHWZLUXODWUHLZ-UHFFFAOYSA-N
Molecular Formula C14H15NO4S2
6,231

4-Nitrophenol 99.0+%, TCI America™

CAS: 100-02-7 Molecular Formula: C6H5NO3 Molecular Weight (g/mol): 139.11 MDL Number: MFCD00007331 InChI Key: BTJIUGUIPKRLHP-UHFFFAOYSA-N Synonym: p-nitrophenol,phenol, 4-nitro,paranitrophenol,niphen,4-hydroxynitrobenzene,p-hydroxynitrobenzene,phenol, p-nitro,mononitrophenol,paranitrofenol,paranitrofenolo PubChem CID: 980 ChEBI: CHEBI:16836 IUPAC Name: 4-nitrophenol SMILES: OC1=CC=C(C=C1)[N+]([O-])=O

PubChem CID 980
CAS 100-02-7
Molecular Weight (g/mol) 139.11
ChEBI CHEBI:16836
MDL Number MFCD00007331
SMILES OC1=CC=C(C=C1)[N+]([O-])=O
Synonym p-nitrophenol,phenol, 4-nitro,paranitrophenol,niphen,4-hydroxynitrobenzene,p-hydroxynitrobenzene,phenol, p-nitro,mononitrophenol,paranitrofenol,paranitrofenolo
IUPAC Name 4-nitrophenol
InChI Key BTJIUGUIPKRLHP-UHFFFAOYSA-N
Molecular Formula C6H5NO3
6,232

2,7-Dihydroxynaphthalene 99.0+%, TCI America™

CAS: 582-17-2 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.17 MDL Number: MFCD00004085 InChI Key: DFQICHCWIIJABH-UHFFFAOYSA-N Synonym: 2,7-dihydroxynaphthalene,2,7-naphthalenediol,naphthalenediol-2,7,unii-0to8e448ud,naphthalenediol-2,7 french,2,7-dihydroxy naphthalene,2,7-naphthalene diol,naphthalene-2-7-diol,2,7-dihdroxynaphthalene PubChem CID: 11397 IUPAC Name: naphthalene-2,7-diol SMILES: OC1=CC2=CC(O)=CC=C2C=C1

PubChem CID 11397
CAS 582-17-2
Molecular Weight (g/mol) 160.17
MDL Number MFCD00004085
SMILES OC1=CC2=CC(O)=CC=C2C=C1
Synonym 2,7-dihydroxynaphthalene,2,7-naphthalenediol,naphthalenediol-2,7,unii-0to8e448ud,naphthalenediol-2,7 french,2,7-dihydroxy naphthalene,2,7-naphthalene diol,naphthalene-2-7-diol,2,7-dihdroxynaphthalene
IUPAC Name naphthalene-2,7-diol
InChI Key DFQICHCWIIJABH-UHFFFAOYSA-N
Molecular Formula C10H8O2
6,233

5-Hydroxy-1,4-naphthoquinone 96.0+%, TCI America™

CAS: 481-39-0 Molecular Formula: C10H6O3 Molecular Weight (g/mol): 174.16 MDL Number: MFCD00001684 InChI Key: KQPYUDDGWXQXHS-UHFFFAOYSA-N Synonym: juglone,5-hydroxy-1,4-naphthoquinone,5-hydroxy-1,4-naphthalenedione,regianin,walnut extract,juglon,nucin,5-hydroxynaphthoquinone,akhnot,yuglon PubChem CID: 3806 ChEBI: CHEBI:15794 IUPAC Name: 5-hydroxy-1,4-dihydronaphthalene-1,4-dione SMILES: OC1=CC=CC2=C1C(=O)C=CC2=O

PubChem CID 3806
CAS 481-39-0
Molecular Weight (g/mol) 174.16
ChEBI CHEBI:15794
MDL Number MFCD00001684
SMILES OC1=CC=CC2=C1C(=O)C=CC2=O
Synonym juglone,5-hydroxy-1,4-naphthoquinone,5-hydroxy-1,4-naphthalenedione,regianin,walnut extract,juglon,nucin,5-hydroxynaphthoquinone,akhnot,yuglon
IUPAC Name 5-hydroxy-1,4-dihydronaphthalene-1,4-dione
InChI Key KQPYUDDGWXQXHS-UHFFFAOYSA-N
Molecular Formula C10H6O3
6,234

Cinnamoyl Chloride 97.0+%, TCI America™

CAS: 17082-09-6 Molecular Formula: C9H7ClO Molecular Weight (g/mol): 166.60 MDL Number: MFCD00000732 InChI Key: WOGITNXCNOTRLK-VOTSOKGWSA-N Synonym: cinnamoyl chloride,cinnamic acid chloride,cinnamic chloride,trans-3-phenylacryloyl chloride,2-propenoyl chloride, 3-phenyl,cinnamoylchloride,e-cinnamoyl chloride,trans-cinnamoyl chloride,2e-3-phenylprop-2-enoyl chloride,3-phenyl-2-propenoyl chloride PubChem CID: 5354261 IUPAC Name: (2E)-3-phenylprop-2-enoyl chloride SMILES: ClC(=O)\C=C\C1=CC=CC=C1

PubChem CID 5354261
CAS 17082-09-6
Molecular Weight (g/mol) 166.60
MDL Number MFCD00000732
SMILES ClC(=O)\C=C\C1=CC=CC=C1
Synonym cinnamoyl chloride,cinnamic acid chloride,cinnamic chloride,trans-3-phenylacryloyl chloride,2-propenoyl chloride, 3-phenyl,cinnamoylchloride,e-cinnamoyl chloride,trans-cinnamoyl chloride,2e-3-phenylprop-2-enoyl chloride,3-phenyl-2-propenoyl chloride
IUPAC Name (2E)-3-phenylprop-2-enoyl chloride
InChI Key WOGITNXCNOTRLK-VOTSOKGWSA-N
Molecular Formula C9H7ClO
6,235

2-Ethylhexyl 2-Cyano-3,3-diphenylacrylate 98.0+%, TCI America™

CAS: 6197-30-4 Molecular Formula: C24H27NO2 Molecular Weight (g/mol): 361.49 MDL Number: MFCD00059260 InChI Key: FMJSMJQBSVNSBF-UHFFFAOYNA-N Synonym: 2-Cyano-3,3-diphenylacrylic Acid 2-Ethylhexyl Ester, Octyl 2-Cyano-3,3-diphenylacrylate PubChem CID: 22571 IUPAC Name: 2-ethylhexyl 2-cyano-3,3-diphenylprop-2-enoate SMILES: CCCCC(CC)COC(=O)C(C#N)=C(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 22571
CAS 6197-30-4
Molecular Weight (g/mol) 361.49
MDL Number MFCD00059260
SMILES CCCCC(CC)COC(=O)C(C#N)=C(C1=CC=CC=C1)C1=CC=CC=C1
Synonym 2-Cyano-3,3-diphenylacrylic Acid 2-Ethylhexyl Ester, Octyl 2-Cyano-3,3-diphenylacrylate
IUPAC Name 2-ethylhexyl 2-cyano-3,3-diphenylprop-2-enoate
InChI Key FMJSMJQBSVNSBF-UHFFFAOYNA-N
Molecular Formula C24H27NO2
6,236

Ethyl 3-Iodobenzoate 98.0+%, TCI America™

CAS: 58313-23-8 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.073 MDL Number: MFCD00044769 InChI Key: POGCXCWRMMXDAQ-UHFFFAOYSA-N Synonym: ethyl-3-iodobenzoate,3-iodobenzoic acid ethyl ester,benzoic acid, 3-iodo-, ethyl ester,ethyl m-iodobenzoate,m-iodobenzoic acid ethyl ester,pubchem3883,ethyl-3-iodo-benzoate,acmc-1aupw,ethyl 3-iodobenzoate,rarechem al bi 0709 PubChem CID: 143542 IUPAC Name: ethyl 3-iodobenzoate SMILES: CCOC(=O)C1=CC(=CC=C1)I

PubChem CID 143542
CAS 58313-23-8
Molecular Weight (g/mol) 276.073
MDL Number MFCD00044769
SMILES CCOC(=O)C1=CC(=CC=C1)I
Synonym ethyl-3-iodobenzoate,3-iodobenzoic acid ethyl ester,benzoic acid, 3-iodo-, ethyl ester,ethyl m-iodobenzoate,m-iodobenzoic acid ethyl ester,pubchem3883,ethyl-3-iodo-benzoate,acmc-1aupw,ethyl 3-iodobenzoate,rarechem al bi 0709
IUPAC Name ethyl 3-iodobenzoate
InChI Key POGCXCWRMMXDAQ-UHFFFAOYSA-N
Molecular Formula C9H9IO2
6,237

Ethyl 4-Iodobenzoate 98.0+%, TCI America™

CAS: 51934-41-9 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.07 MDL Number: MFCD00017344 InChI Key: YCBJOQUNPLTBGG-UHFFFAOYSA-N Synonym: p-iodobenzoic acid ethyl ester,4-iodobenzoic acid ethyl ester,ethyl p-iodobenzoate,ethyl-4-iodobenzoate,benzoicacid,4-iodo-,ethylester,4-iodo-benzoic acid ethyl ester,benzoic acid, 4-iodo-, ethyl ester,ethyl4-iodobenzoate,ethyl-4 iodobenzoate,ethyl,4-iodobenzoate PubChem CID: 142891 IUPAC Name: ethyl 4-iodobenzoate SMILES: CCOC(=O)C1=CC=C(I)C=C1

PubChem CID 142891
CAS 51934-41-9
Molecular Weight (g/mol) 276.07
MDL Number MFCD00017344
SMILES CCOC(=O)C1=CC=C(I)C=C1
Synonym p-iodobenzoic acid ethyl ester,4-iodobenzoic acid ethyl ester,ethyl p-iodobenzoate,ethyl-4-iodobenzoate,benzoicacid,4-iodo-,ethylester,4-iodo-benzoic acid ethyl ester,benzoic acid, 4-iodo-, ethyl ester,ethyl4-iodobenzoate,ethyl-4 iodobenzoate,ethyl,4-iodobenzoate
IUPAC Name ethyl 4-iodobenzoate
InChI Key YCBJOQUNPLTBGG-UHFFFAOYSA-N
Molecular Formula C9H9IO2
6,238

[Bis(trifluoroacetoxy)iodo]pentafluorobenzene 97.0+%, TCI America™

CAS: 14353-88-9 Molecular Formula: C10F11IO4 Molecular Weight (g/mol): 519.99 MDL Number: MFCD00191612 InChI Key: OQWAXRPJEPTTSZ-UHFFFAOYSA-N Synonym: Pentafluoro[bis(trifluoroacetoxy)iodo]benzene PubChem CID: 626316 IUPAC Name: (2,3,4,5,6-pentafluorophenyl)[(2,2,2-trifluoroacetyl)oxy]-λ³-iodanyl 2,2,2-trifluoroacetate SMILES: FC1=C(F)C(F)=C([I](OC(=O)C(F)(F)F)OC(=O)C(F)(F)F)C(F)=C1F

PubChem CID 626316
CAS 14353-88-9
Molecular Weight (g/mol) 519.99
MDL Number MFCD00191612
SMILES FC1=C(F)C(F)=C([I](OC(=O)C(F)(F)F)OC(=O)C(F)(F)F)C(F)=C1F
Synonym Pentafluoro[bis(trifluoroacetoxy)iodo]benzene
IUPAC Name (2,3,4,5,6-pentafluorophenyl)[(2,2,2-trifluoroacetyl)oxy]-λ³-iodanyl 2,2,2-trifluoroacetate
InChI Key OQWAXRPJEPTTSZ-UHFFFAOYSA-N
Molecular Formula C10F11IO4
6,239

Isoamyl Benzoate 98.0+%, TCI America™

CAS: 94-46-2 Molecular Formula: C12H16O2 Molecular Weight (g/mol): 192.258 MDL Number: MFCD00026515 InChI Key: MLLAPOCBLWUFAP-UHFFFAOYSA-N Synonym: Benzoic Acid Isoamyl Ester, Isopentyl Benzoate PubChem CID: 7193 IUPAC Name: 3-methylbutyl benzoate SMILES: CC(C)CCOC(=O)C1=CC=CC=C1

PubChem CID 7193
CAS 94-46-2
Molecular Weight (g/mol) 192.258
MDL Number MFCD00026515
SMILES CC(C)CCOC(=O)C1=CC=CC=C1
Synonym Benzoic Acid Isoamyl Ester, Isopentyl Benzoate
IUPAC Name 3-methylbutyl benzoate
InChI Key MLLAPOCBLWUFAP-UHFFFAOYSA-N
Molecular Formula C12H16O2
6,240

1,2-Dimethoxybenzene 99.0+%, TCI America™

CAS: 91-16-7 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00008357 InChI Key: ABDKAPXRBAPSQN-UHFFFAOYSA-N Synonym: veratrole,veratrol,pyrocatechol dimethyl ether,o-dimethoxybenzene,catechol dimethyl ether,benzene, 1,2-dimethoxy,2-methoxyanisole,o,o-dimethyl catechol,2-dimethoxybenzol,benzene, o-dimethoxy PubChem CID: 7043 ChEBI: CHEBI:59114 IUPAC Name: 1,2-dimethoxybenzene SMILES: COC1=CC=CC=C1OC

PubChem CID 7043
CAS 91-16-7
Molecular Weight (g/mol) 138.166
ChEBI CHEBI:59114
MDL Number MFCD00008357
SMILES COC1=CC=CC=C1OC
Synonym veratrole,veratrol,pyrocatechol dimethyl ether,o-dimethoxybenzene,catechol dimethyl ether,benzene, 1,2-dimethoxy,2-methoxyanisole,o,o-dimethyl catechol,2-dimethoxybenzol,benzene, o-dimethoxy
IUPAC Name 1,2-dimethoxybenzene
InChI Key ABDKAPXRBAPSQN-UHFFFAOYSA-N
Molecular Formula C8H10O2