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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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6,331 – 6,345 of 78,434 results
6,331

4-Chlororesorcinol 98.0+%, TCI America™

CAS: 95-88-5 Molecular Formula: C6H5ClO2 Molecular Weight (g/mol): 144.55 MDL Number: MFCD00002273 InChI Key: JQVAPEJNIZULEK-UHFFFAOYSA-N Synonym: 4-chlororesorcinol,1,3-benzenediol, 4-chloro,p-chlororesorcinol,4-chlororesorcin,resorcinol, 4-chloro,6-chlororesorcinol,4-chloro-1,3-dihydroxybenzene,4-chloro-1,3-benzenediol,2,4-dihydroxychlorobenzene,1,3-dihydroxy-4-chlorobenzene PubChem CID: 1731 IUPAC Name: 4-chlorobenzene-1,3-diol SMILES: OC1=CC=C(Cl)C(O)=C1

PubChem CID 1731
CAS 95-88-5
Molecular Weight (g/mol) 144.55
MDL Number MFCD00002273
SMILES OC1=CC=C(Cl)C(O)=C1
Synonym 4-chlororesorcinol,1,3-benzenediol, 4-chloro,p-chlororesorcinol,4-chlororesorcin,resorcinol, 4-chloro,6-chlororesorcinol,4-chloro-1,3-dihydroxybenzene,4-chloro-1,3-benzenediol,2,4-dihydroxychlorobenzene,1,3-dihydroxy-4-chlorobenzene
IUPAC Name 4-chlorobenzene-1,3-diol
InChI Key JQVAPEJNIZULEK-UHFFFAOYSA-N
Molecular Formula C6H5ClO2
6,332

3,5-Bis(trifluoromethyl)phenylacetic Acid 97.0+%, TCI America™

CAS: 85068-33-3 Molecular Formula: C10H6F6O2 Molecular Weight (g/mol): 272.15 MDL Number: MFCD00009908 InChI Key: PAWSKKHEEYTXSA-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl phenylacetic acid,2-3,5-bis trifluoromethyl phenyl acetic acid,3,5-bis-trifluoromethylphenylacetic acid,mbt-paa,2-3,5-di trifluoromethyl phenyl acetic acid,benzeneacetic acid, 3,5-bis trifluoromethyl,3,5-bis trifluoromethyl phenyl acetic acid,3,5-di trifluoromethyl phenylacetic acid,3,5-bis trifluoromethyl phenylaceticacid PubChem CID: 123587 IUPAC Name: 2-[3,5-bis(trifluoromethyl)phenyl]acetic acid SMILES: OC(=O)CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

PubChem CID 123587
CAS 85068-33-3
Molecular Weight (g/mol) 272.15
MDL Number MFCD00009908
SMILES OC(=O)CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F
Synonym 3,5-bis trifluoromethyl phenylacetic acid,2-3,5-bis trifluoromethyl phenyl acetic acid,3,5-bis-trifluoromethylphenylacetic acid,mbt-paa,2-3,5-di trifluoromethyl phenyl acetic acid,benzeneacetic acid, 3,5-bis trifluoromethyl,3,5-bis trifluoromethyl phenyl acetic acid,3,5-di trifluoromethyl phenylacetic acid,3,5-bis trifluoromethyl phenylaceticacid
IUPAC Name 2-[3,5-bis(trifluoromethyl)phenyl]acetic acid
InChI Key PAWSKKHEEYTXSA-UHFFFAOYSA-N
Molecular Formula C10H6F6O2
6,333

4-Bromo-3-(trifluoromethyl)benzonitrile 98.0+%, TCI America™

CAS: 1735-53-1 Molecular Formula: C8H3BrF3N Molecular Weight (g/mol): 250.018 MDL Number: MFCD03095347 InChI Key: KSXUIQQDHHFSRN-UHFFFAOYSA-N Synonym: 4-bromo-3-trifluoromethyl benzonitrile,3-trifluoromethyl-4-bromobenzonitrile,2-bromo-5-cyanobenzotrifluoride,3-trifluoromethyl-4-bromo benzonitrile,benzonitrile, 4-bromo-3-trifluoromethyl,4-bromo-3-trifluoromethyl benzenecarbonitrile,4-bromo-3-trifluoromethyl-benzonitrile,pubchem1576,intermediates-zcf02288,acmc-209e6z PubChem CID: 10800647 IUPAC Name: 4-bromo-3-(trifluoromethyl)benzonitrile SMILES: C1=CC(=C(C=C1C#N)C(F)(F)F)Br

PubChem CID 10800647
CAS 1735-53-1
Molecular Weight (g/mol) 250.018
MDL Number MFCD03095347
SMILES C1=CC(=C(C=C1C#N)C(F)(F)F)Br
Synonym 4-bromo-3-trifluoromethyl benzonitrile,3-trifluoromethyl-4-bromobenzonitrile,2-bromo-5-cyanobenzotrifluoride,3-trifluoromethyl-4-bromo benzonitrile,benzonitrile, 4-bromo-3-trifluoromethyl,4-bromo-3-trifluoromethyl benzenecarbonitrile,4-bromo-3-trifluoromethyl-benzonitrile,pubchem1576,intermediates-zcf02288,acmc-209e6z
IUPAC Name 4-bromo-3-(trifluoromethyl)benzonitrile
InChI Key KSXUIQQDHHFSRN-UHFFFAOYSA-N
Molecular Formula C8H3BrF3N
6,334

N-(6-Aminohexyl)-5-chloro-1-naphthalenesulfonamide Hydrochloride 98.0+%, TCI America™

CAS: 61714-27-0 Molecular Formula: C16H22Cl2N2O2S Molecular Weight (g/mol): 377.32 MDL Number: MFCD00012559 InChI Key: OMMOSRLIFSCDBL-UHFFFAOYSA-N Synonym: w-7 hydrochloride,n-6-aminohexyl-5-chloro-1-naphthalenesulfonamide hydrochloride,w-7, hydrochloride,n-6-aminohexyl-5-chloronaphthalene-1-sulfonamide hydrochloride,c16h21cln2o2s hydrochloride,1-naphthalenesulfonamide, n-6-aminohexyl-5-chloro-, monohydrochloride,n-6-aminohexyl-5-chloro-1-naphthalenesulfonamide monohydrochloride,n-6-aminohexyl-5-chloro-1-naphthalenesulfonamide hcl,n-6-aminohexyl-5-chloro-1-naphthalenesulfonamide, hcl,n-aminohexyl-5-chloro-1-napthalenesulfonamide hydrochloride PubChem CID: 124887 IUPAC Name: hydrogen N-(6-aminohexyl)-5-chloronaphthalene-1-sulfonamide chloride SMILES: [H+].[Cl-].NCCCCCCNS(=O)(=O)C1=C2C=CC=C(Cl)C2=CC=C1

PubChem CID 124887
CAS 61714-27-0
Molecular Weight (g/mol) 377.32
MDL Number MFCD00012559
SMILES [H+].[Cl-].NCCCCCCNS(=O)(=O)C1=C2C=CC=C(Cl)C2=CC=C1
Synonym w-7 hydrochloride,n-6-aminohexyl-5-chloro-1-naphthalenesulfonamide hydrochloride,w-7, hydrochloride,n-6-aminohexyl-5-chloronaphthalene-1-sulfonamide hydrochloride,c16h21cln2o2s hydrochloride,1-naphthalenesulfonamide, n-6-aminohexyl-5-chloro-, monohydrochloride,n-6-aminohexyl-5-chloro-1-naphthalenesulfonamide monohydrochloride,n-6-aminohexyl-5-chloro-1-naphthalenesulfonamide hcl,n-6-aminohexyl-5-chloro-1-naphthalenesulfonamide, hcl,n-aminohexyl-5-chloro-1-napthalenesulfonamide hydrochloride
IUPAC Name hydrogen N-(6-aminohexyl)-5-chloronaphthalene-1-sulfonamide chloride
InChI Key OMMOSRLIFSCDBL-UHFFFAOYSA-N
Molecular Formula C16H22Cl2N2O2S
6,335

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

CAS: 5748-42-5 Molecular Formula: C17H18O2 Molecular Weight (g/mol): 254.329 MDL Number: MFCD01631300 InChI Key: HZIOPONJCVOCFE-UHFFFAOYSA-N PubChem CID: 541479 IUPAC Name: 4-(4-tert-butylphenyl)benzoic acid SMILES: CC(C)(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

PubChem CID 541479
CAS 5748-42-5
Molecular Weight (g/mol) 254.329
MDL Number MFCD01631300
SMILES CC(C)(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
IUPAC Name 4-(4-tert-butylphenyl)benzoic acid
InChI Key HZIOPONJCVOCFE-UHFFFAOYSA-N
Molecular Formula C17H18O2
6,336

o-Anisidine 98.0+%, TCI America™

CAS: 90-04-0 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.155 MDL Number: MFCD00007688 InChI Key: VMPITZXILSNTON-UHFFFAOYSA-N Synonym: o-anisidine,2-anisidine,ortho-anisidine,2-aminoanisole,o-methoxyaniline,o-aminoanisole,benzenamine, 2-methoxy,2-methoxybenzenamine,o-methoxyphenylamine,o-anisylamine PubChem CID: 7000 ChEBI: CHEBI:82288 IUPAC Name: 2-methoxyaniline SMILES: COC1=CC=CC=C1N

PubChem CID 7000
CAS 90-04-0
Molecular Weight (g/mol) 123.155
ChEBI CHEBI:82288
MDL Number MFCD00007688
SMILES COC1=CC=CC=C1N
Synonym o-anisidine,2-anisidine,ortho-anisidine,2-aminoanisole,o-methoxyaniline,o-aminoanisole,benzenamine, 2-methoxy,2-methoxybenzenamine,o-methoxyphenylamine,o-anisylamine
IUPAC Name 2-methoxyaniline
InChI Key VMPITZXILSNTON-UHFFFAOYSA-N
Molecular Formula C7H9NO
6,337

(3-Methylphenyl)(2,4,6-trimethylphenyl)iodonium Trifluoromethanesulfonate 98.0+%, TCI America™

CAS: 197245-87-7 Molecular Formula: C17H18F3IO3S Molecular Weight (g/mol): 486.29 MDL Number: MFCD20264883 InChI Key: JFTSJYFKINVLMA-UHFFFAOYSA-M Synonym: Mesityl(m-tolyl)iodonium Triflate PubChem CID: 10719708 IUPAC Name: (3-methylphenyl)(2,4,6-trimethylphenyl)iodanium trifluoromethanesulfonate SMILES: [O-]S(=O)(=O)C(F)(F)F.CC1=CC([I+]C2=C(C)C=C(C)C=C2C)=CC=C1

PubChem CID 10719708
CAS 197245-87-7
Molecular Weight (g/mol) 486.29
MDL Number MFCD20264883
SMILES [O-]S(=O)(=O)C(F)(F)F.CC1=CC([I+]C2=C(C)C=C(C)C=C2C)=CC=C1
Synonym Mesityl(m-tolyl)iodonium Triflate
IUPAC Name (3-methylphenyl)(2,4,6-trimethylphenyl)iodanium trifluoromethanesulfonate
InChI Key JFTSJYFKINVLMA-UHFFFAOYSA-M
Molecular Formula C17H18F3IO3S
6,338

2,6-Dinitro-4-(trifluoromethyl)phenol 97.0+%, TCI America™

CAS: 393-77-1 Molecular Formula: C7H3F3N2O5 Molecular Weight (g/mol): 252.105 MDL Number: MFCD00194260 InChI Key: FXZGYEWQIGIFMC-UHFFFAOYSA-N Synonym: 4-Hydroxy-3,5-dinitrobenzotrifluoride, alpha,alpha,alpha-Trifluoro-2,6-dinitro-p-cresol PubChem CID: 164591 IUPAC Name: 2,6-dinitro-4-(trifluoromethyl)phenol SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])C(F)(F)F

PubChem CID 164591
CAS 393-77-1
Molecular Weight (g/mol) 252.105
MDL Number MFCD00194260
SMILES C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])C(F)(F)F
Synonym 4-Hydroxy-3,5-dinitrobenzotrifluoride, alpha,alpha,alpha-Trifluoro-2,6-dinitro-p-cresol
IUPAC Name 2,6-dinitro-4-(trifluoromethyl)phenol
InChI Key FXZGYEWQIGIFMC-UHFFFAOYSA-N
Molecular Formula C7H3F3N2O5
6,339

3,5-Dimethoxyaniline 98.0+%, TCI America™

CAS: 10272-07-8 Molecular Formula: C8H11NO2 Molecular Weight (g/mol): 153.18 MDL Number: MFCD00008392 InChI Key: WNRGWPVJGDABME-UHFFFAOYSA-N Synonym: benzenamine, 3,5-dimethoxy,3,5-dimethoxybenzeneamine,5-aminoresorcinol dimethyl ether,3,5-dimethoxy-phenylamine,3,5-dimethoxyanaline,3,5-dimethoxy aniline,5-aminoresorcinol dimethylether,3,5-dimethoxybenzenamine,3,5-dimethoxyphenylamine,pubchem4423 PubChem CID: 66301 IUPAC Name: 3,5-dimethoxyaniline SMILES: COC1=CC(OC)=CC(N)=C1

PubChem CID 66301
CAS 10272-07-8
Molecular Weight (g/mol) 153.18
MDL Number MFCD00008392
SMILES COC1=CC(OC)=CC(N)=C1
Synonym benzenamine, 3,5-dimethoxy,3,5-dimethoxybenzeneamine,5-aminoresorcinol dimethyl ether,3,5-dimethoxy-phenylamine,3,5-dimethoxyanaline,3,5-dimethoxy aniline,5-aminoresorcinol dimethylether,3,5-dimethoxybenzenamine,3,5-dimethoxyphenylamine,pubchem4423
IUPAC Name 3,5-dimethoxyaniline
InChI Key WNRGWPVJGDABME-UHFFFAOYSA-N
Molecular Formula C8H11NO2
6,340

2-Bromo-4-methoxyphenol 98.0+%, TCI America™

CAS: 17332-11-5 Molecular Formula: C7H7BrO2 Molecular Weight (g/mol): 203.04 MDL Number: MFCD02113712 InChI Key: LTMSUXSPKZRMAB-UHFFFAOYSA-N Synonym: 3-Bromo-4-hydroxyanisole PubChem CID: 297382 IUPAC Name: 2-bromo-4-methoxyphenol SMILES: COC1=CC=C(O)C(Br)=C1

PubChem CID 297382
CAS 17332-11-5
Molecular Weight (g/mol) 203.04
MDL Number MFCD02113712
SMILES COC1=CC=C(O)C(Br)=C1
Synonym 3-Bromo-4-hydroxyanisole
IUPAC Name 2-bromo-4-methoxyphenol
InChI Key LTMSUXSPKZRMAB-UHFFFAOYSA-N
Molecular Formula C7H7BrO2
6,341

4-Bromobenz[a]anthracene 97.0+%, TCI America™

CAS: 61921-39-9 Molecular Formula: C18H11Br Molecular Weight (g/mol): 307.19 MDL Number: MFCD25371993 InChI Key: ILVKEMDEUCXCAB-UHFFFAOYSA-N Synonym: 4-Bromotetraphene PubChem CID: 182324 IUPAC Name: 4-bromobenzo[a]anthracene SMILES: C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=CC=C4Br

PubChem CID 182324
CAS 61921-39-9
Molecular Weight (g/mol) 307.19
MDL Number MFCD25371993
SMILES C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=CC=C4Br
Synonym 4-Bromotetraphene
IUPAC Name 4-bromobenzo[a]anthracene
InChI Key ILVKEMDEUCXCAB-UHFFFAOYSA-N
Molecular Formula C18H11Br
6,342

(4-Bromophenyl)phosphonic Acid 98.0+%, TCI America™

CAS: 16839-13-7 Molecular Formula: C6H6BrO3P Molecular Weight (g/mol): 236.989 MDL Number: MFCD00159409 InChI Key: XDGIQCFWQNHSMV-UHFFFAOYSA-N PubChem CID: 95011 IUPAC Name: (4-bromophenyl)phosphonic acid SMILES: C1=CC(=CC=C1P(=O)(O)O)Br

PubChem CID 95011
CAS 16839-13-7
Molecular Weight (g/mol) 236.989
MDL Number MFCD00159409
SMILES C1=CC(=CC=C1P(=O)(O)O)Br
IUPAC Name (4-bromophenyl)phosphonic acid
InChI Key XDGIQCFWQNHSMV-UHFFFAOYSA-N
Molecular Formula C6H6BrO3P
6,343

4-Isopropylphenol 99.0+%, TCI America™

CAS: 99-89-8 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00002372 InChI Key: YQUQWHNMBPIWGK-UHFFFAOYSA-N Synonym: 4-isopropylphenol,p-isopropylphenol,p-cumenol,australol,phenol, 4-1-methylethyl,4-1-methylethyl phenol,1-hydroxy-4-isopropylbenzene,4-propan-2-yl phenol,phenol, p-isopropyl,para-isopropylphenol PubChem CID: 7465 IUPAC Name: 4-propan-2-ylphenol SMILES: CC(C)C1=CC=C(C=C1)O

PubChem CID 7465
CAS 99-89-8
Molecular Weight (g/mol) 136.194
MDL Number MFCD00002372
SMILES CC(C)C1=CC=C(C=C1)O
Synonym 4-isopropylphenol,p-isopropylphenol,p-cumenol,australol,phenol, 4-1-methylethyl,4-1-methylethyl phenol,1-hydroxy-4-isopropylbenzene,4-propan-2-yl phenol,phenol, p-isopropyl,para-isopropylphenol
IUPAC Name 4-propan-2-ylphenol
InChI Key YQUQWHNMBPIWGK-UHFFFAOYSA-N
Molecular Formula C9H12O
6,344

trans,trans-4'-Propyl-4-(3,4,5-trifluorophenyl)bicyclohexyl 98.0+%, TCI America™

CAS: 131819-23-3 Molecular Formula: C21H29F3 Molecular Weight (g/mol): 338.458 InChI Key: FEWMLRARKGRCCE-UHFFFAOYSA-N Synonym: trans,trans-4'-propyl-4-3,4,5-trifluorophenyl bicyclohexyl,trans-4-3,4,5-trifluorophenyl-trans-4'-propylbicyclohexane,trans-4-n-propyl-4'-3,4,5-trifluorophenyl bicyclohexyl,benzene, 1,2,3-trifluoro-5-trans,trans-4'-propyl 1,1'-bicyclohexyl-4-yl,4-3,4,5-trifluorophenyl-4'-propyl-1,1'-bicyclohexane,trans,trans-1-4'-propylbicyclohexyl-3,4,5-trifluorobenzene,1,2,3-trifluoro-5-trans,trans-4-propyl 1,1-bicyclohexyl-4-yl benzene,all-trans-4-propyl-4'-3,4,5-trifluorophenyl bi cyclohexane,1s,1'r,4r,4'r-4-propyl-4'-3,4,5-trifluorophenyl-1,1'-bi cyclohexane,1s,4r-4-propyl-4'-3,4,5-trifluorophenyl-1,1'-bi cyclohexane PubChem CID: 11772113 IUPAC Name: 1,2,3-trifluoro-5-[4-(4-propylcyclohexyl)cyclohexyl]benzene SMILES: CCCC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C(=C3)F)F)F

PubChem CID 11772113
CAS 131819-23-3
Molecular Weight (g/mol) 338.458
SMILES CCCC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C(=C3)F)F)F
Synonym trans,trans-4'-propyl-4-3,4,5-trifluorophenyl bicyclohexyl,trans-4-3,4,5-trifluorophenyl-trans-4'-propylbicyclohexane,trans-4-n-propyl-4'-3,4,5-trifluorophenyl bicyclohexyl,benzene, 1,2,3-trifluoro-5-trans,trans-4'-propyl 1,1'-bicyclohexyl-4-yl,4-3,4,5-trifluorophenyl-4'-propyl-1,1'-bicyclohexane,trans,trans-1-4'-propylbicyclohexyl-3,4,5-trifluorobenzene,1,2,3-trifluoro-5-trans,trans-4-propyl 1,1-bicyclohexyl-4-yl benzene,all-trans-4-propyl-4'-3,4,5-trifluorophenyl bi cyclohexane,1s,1'r,4r,4'r-4-propyl-4'-3,4,5-trifluorophenyl-1,1'-bi cyclohexane,1s,4r-4-propyl-4'-3,4,5-trifluorophenyl-1,1'-bi cyclohexane
IUPAC Name 1,2,3-trifluoro-5-[4-(4-propylcyclohexyl)cyclohexyl]benzene
InChI Key FEWMLRARKGRCCE-UHFFFAOYSA-N
Molecular Formula C21H29F3
6,345

4-Bromo-2-fluorophenol 98.0+%, TCI America™

CAS: 2105-94-4 Molecular Formula: C6H4BrFO Molecular Weight (g/mol): 191.00 MDL Number: MFCD00011722 InChI Key: RYVOZMPTISNBDB-UHFFFAOYSA-N Synonym: 2-fluoro-4-bromophenol,4-bromo-2-fluoro-phenol,phenol, 4-bromo-2-fluoro,4-bromo-2-fluoro phenol,pubchem1488,p-bromo-o-fluorophenol,2-fluoro-4-bromo phenol,acmc-209fh4,ksc204a3n,3-fluoro-4-hydroxy-bromobenzene PubChem CID: 2724981 IUPAC Name: 4-bromo-2-fluorophenol SMILES: OC1=CC=C(Br)C=C1F

PubChem CID 2724981
CAS 2105-94-4
Molecular Weight (g/mol) 191.00
MDL Number MFCD00011722
SMILES OC1=CC=C(Br)C=C1F
Synonym 2-fluoro-4-bromophenol,4-bromo-2-fluoro-phenol,phenol, 4-bromo-2-fluoro,4-bromo-2-fluoro phenol,pubchem1488,p-bromo-o-fluorophenol,2-fluoro-4-bromo phenol,acmc-209fh4,ksc204a3n,3-fluoro-4-hydroxy-bromobenzene
IUPAC Name 4-bromo-2-fluorophenol
InChI Key RYVOZMPTISNBDB-UHFFFAOYSA-N
Molecular Formula C6H4BrFO