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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 (94,117)
Phenols (18,696)
Naphthalenes (5,706)
Phenol esters (2,344)
Unsubstituted Phenols (1,279)
Fluorenes (1,274)
Thiophenols (644)
Anthracenes (489)
Indanes (414)
Phenanthrenes and derivatives (362)
Tetralins (339)
Triphenyl compounds (278)
Pyrenes (274)
Dibenzocycloheptenes (61)
Naphthacenes (37)
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 113,112 results
6,226

N-(4-Methoxybenzylidene)aniline 98.0+%, TCI America™

CAS: 836-41-9 Molecular Formula: C14H13NO Molecular Weight (g/mol): 211.26 MDL Number: MFCD00025836 InChI Key: MSWPGMRTURVKRJ-UHFFFAOYSA-N Synonym: n-4-methoxybenzylidene aniline,e-n-4-methoxybenzylidene aniline,n-p-anisal aniline,n-p-anisylideneaniline,1-4-methoxyphenyl-n-phenylmethanimine,4-methoxybenzyliden-anilin,4-methoxybenzylideneaniline,1e-1-4-methoxyphenyl-n-phenylmethanimine,p-methoxybenzylidene-phenyl-amine,n-4-methoxyphenyl methylidene aniline # PubChem CID: 98633 IUPAC Name: 1-(4-methoxyphenyl)-N-phenylmethanimine SMILES: COC1=CC=C(C=NC2=CC=CC=C2)C=C1

PubChem CID 98633
CAS 836-41-9
Molecular Weight (g/mol) 211.26
MDL Number MFCD00025836
SMILES COC1=CC=C(C=NC2=CC=CC=C2)C=C1
Synonym n-4-methoxybenzylidene aniline,e-n-4-methoxybenzylidene aniline,n-p-anisal aniline,n-p-anisylideneaniline,1-4-methoxyphenyl-n-phenylmethanimine,4-methoxybenzyliden-anilin,4-methoxybenzylideneaniline,1e-1-4-methoxyphenyl-n-phenylmethanimine,p-methoxybenzylidene-phenyl-amine,n-4-methoxyphenyl methylidene aniline #
IUPAC Name 1-(4-methoxyphenyl)-N-phenylmethanimine
InChI Key MSWPGMRTURVKRJ-UHFFFAOYSA-N
Molecular Formula C14H13NO
6,227

4-(Dimethylamino)benzenethiol 98.0+%, TCI America™

CAS: 4946-22-9 Molecular Formula: C8H11NS Molecular Weight (g/mol): 153.243 MDL Number: MFCD01658123 InChI Key: PQSBRHXGVPVYFJ-UHFFFAOYSA-N Synonym: 4-(Dimethylamino)thiophenol, 4-Mercapto-N,N-dimethylaniline PubChem CID: 21061 IUPAC Name: 4-(dimethylamino)benzenethiol SMILES: CN(C)C1=CC=C(C=C1)S

PubChem CID 21061
CAS 4946-22-9
Molecular Weight (g/mol) 153.243
MDL Number MFCD01658123
SMILES CN(C)C1=CC=C(C=C1)S
Synonym 4-(Dimethylamino)thiophenol, 4-Mercapto-N,N-dimethylaniline
IUPAC Name 4-(dimethylamino)benzenethiol
InChI Key PQSBRHXGVPVYFJ-UHFFFAOYSA-N
Molecular Formula C8H11NS
6,228

p-Tolyldiethanolamine 98.0+%, TCI America™

CAS: 3077-12-1 Molecular Formula: C11H17NO2 Molecular Weight (g/mol): 195.26 MDL Number: MFCD00020580 InChI Key: JUVSRZCUMWZBFK-UHFFFAOYSA-N PubChem CID: 76497 IUPAC Name: 2-[N-(2-hydroxyethyl)-4-methylanilino]ethanol SMILES: CC1=CC=C(C=C1)N(CCO)CCO

PubChem CID 76497
CAS 3077-12-1
Molecular Weight (g/mol) 195.26
MDL Number MFCD00020580
SMILES CC1=CC=C(C=C1)N(CCO)CCO
IUPAC Name 2-[N-(2-hydroxyethyl)-4-methylanilino]ethanol
InChI Key JUVSRZCUMWZBFK-UHFFFAOYSA-N
Molecular Formula C11H17NO2
6,229

Diphenhydramine 98.0+%, TCI America™

CAS: 58-73-1 Molecular Formula: C17H21NO Molecular Weight (g/mol): 255.361 MDL Number: MFCD00274173 InChI Key: ZZVUWRFHKOJYTH-UHFFFAOYSA-N Synonym: 2-Diphenylmethoxy-N,N-dimethylethylamine, 2-(Benzhydryloxy)-N,N-dimethylethylamine PubChem CID: 3100 ChEBI: CHEBI:4636 IUPAC Name: 2-benzhydryloxy-N,N-dimethylethanamine SMILES: CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2

PubChem CID 3100
CAS 58-73-1
Molecular Weight (g/mol) 255.361
ChEBI CHEBI:4636
MDL Number MFCD00274173
SMILES CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2
Synonym 2-Diphenylmethoxy-N,N-dimethylethylamine, 2-(Benzhydryloxy)-N,N-dimethylethylamine
IUPAC Name 2-benzhydryloxy-N,N-dimethylethanamine
InChI Key ZZVUWRFHKOJYTH-UHFFFAOYSA-N
Molecular Formula C17H21NO
6,230

2-(3-Bromophenyl)ethyl Alcohol 98.0+%, TCI America™

CAS: 28229-69-8 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.06 MDL Number: MFCD00191857 InChI Key: PTTFLKHCSZSFOL-UHFFFAOYSA-N Synonym: 3-bromophenethyl alcohol,2-3-bromophenyl ethanol,2-3-bromophenyl ethan-1-ol,benzeneethanol, 3-bromo,3-bromophenethylalcohol,3-bromobenzeneethanol,3-2-hydroxyethyl bromobenzene,2-3-bromophenyl ethyl alcohol,pubchem14821,3-bromo-phenethyl-alcohol PubChem CID: 2734090 IUPAC Name: 2-(3-bromophenyl)ethan-1-ol SMILES: OCCC1=CC=CC(Br)=C1

PubChem CID 2734090
CAS 28229-69-8
Molecular Weight (g/mol) 201.06
MDL Number MFCD00191857
SMILES OCCC1=CC=CC(Br)=C1
Synonym 3-bromophenethyl alcohol,2-3-bromophenyl ethanol,2-3-bromophenyl ethan-1-ol,benzeneethanol, 3-bromo,3-bromophenethylalcohol,3-bromobenzeneethanol,3-2-hydroxyethyl bromobenzene,2-3-bromophenyl ethyl alcohol,pubchem14821,3-bromo-phenethyl-alcohol
IUPAC Name 2-(3-bromophenyl)ethan-1-ol
InChI Key PTTFLKHCSZSFOL-UHFFFAOYSA-N
Molecular Formula C8H9BrO
6,231

Indan 95.0+%, TCI America™

CAS: 496-11-7 Molecular Formula: C9H10 Molecular Weight (g/mol): 118.179 MDL Number: MFCD00003795 InChI Key: PQNFLJBBNBOBRQ-UHFFFAOYSA-N Synonym: indan,indane,hydrindene,benzocyclopentane,1h-indene, 2,3-dihydro,2,3-dihydroindene,1,2-hydrindene,hydrindonaphthene,indane alkane,indene, 2,3-dihydro PubChem CID: 10326 ChEBI: CHEBI:37911 IUPAC Name: 2,3-dihydro-1H-indene SMILES: C1CC2=CC=CC=C2C1

PubChem CID 10326
CAS 496-11-7
Molecular Weight (g/mol) 118.179
ChEBI CHEBI:37911
MDL Number MFCD00003795
SMILES C1CC2=CC=CC=C2C1
Synonym indan,indane,hydrindene,benzocyclopentane,1h-indene, 2,3-dihydro,2,3-dihydroindene,1,2-hydrindene,hydrindonaphthene,indane alkane,indene, 2,3-dihydro
IUPAC Name 2,3-dihydro-1H-indene
InChI Key PQNFLJBBNBOBRQ-UHFFFAOYSA-N
Molecular Formula C9H10
6,232

4-(4-Hydroxyphenyl)-2-butanone 99.0+%, TCI America™

CAS: 5471-51-2 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00002394 InChI Key: NJGBTKGETPDVIK-UHFFFAOYSA-N Synonym: 4-4-hydroxyphenyl-2-butanone,raspberry ketone,4-4-hydroxyphenyl butan-2-one,frambinone,oxyphenalon,rheosmin,4-p-hydroxyphenyl-2-butanone,4-hydroxybenzylacetone,betuligenol,rasketone PubChem CID: 21648 ChEBI: CHEBI:68656 IUPAC Name: 4-(4-hydroxyphenyl)butan-2-one SMILES: CC(=O)CCC1=CC=C(C=C1)O

PubChem CID 21648
CAS 5471-51-2
Molecular Weight (g/mol) 164.204
ChEBI CHEBI:68656
MDL Number MFCD00002394
SMILES CC(=O)CCC1=CC=C(C=C1)O
Synonym 4-4-hydroxyphenyl-2-butanone,raspberry ketone,4-4-hydroxyphenyl butan-2-one,frambinone,oxyphenalon,rheosmin,4-p-hydroxyphenyl-2-butanone,4-hydroxybenzylacetone,betuligenol,rasketone
IUPAC Name 4-(4-hydroxyphenyl)butan-2-one
InChI Key NJGBTKGETPDVIK-UHFFFAOYSA-N
Molecular Formula C10H12O2
6,233

Anthracene 97.0+%, TCI America™

CAS: 120-12-7 Molecular Formula: C14H10 Molecular Weight (g/mol): 178.23 MDL Number: MFCD00001240 InChI Key: MWPLVEDNUUSJAV-UHFFFAOYSA-N Synonym: paranaphthalene,anthracin,green oil,anthracen,tetra olive n2g,anthracen german,anthrazen,anthracene, pure,bis-alkylamino,ccris 767 PubChem CID: 8418 ChEBI: CHEBI:35298 IUPAC Name: anthracene SMILES: C1=CC2=CC3=CC=CC=C3C=C2C=C1

PubChem CID 8418
CAS 120-12-7
Molecular Weight (g/mol) 178.23
ChEBI CHEBI:35298
MDL Number MFCD00001240
SMILES C1=CC2=CC3=CC=CC=C3C=C2C=C1
Synonym paranaphthalene,anthracin,green oil,anthracen,tetra olive n2g,anthracen german,anthrazen,anthracene, pure,bis-alkylamino,ccris 767
IUPAC Name anthracene
InChI Key MWPLVEDNUUSJAV-UHFFFAOYSA-N
Molecular Formula C14H10
6,234

Isoamyl Salicylate (contains 2-Methylbutyl Salicylate), TCI America™

CAS: 87-20-7 Molecular Formula: C12H16O3 Molecular Weight (g/mol): 208.257 MDL Number: MFCD00020037 InChI Key: PMGCQNGBLMMXEW-UHFFFAOYSA-N Synonym: Isopentyl Salicylate, Salicylic Acid Isoamyl Ester, Isopentyl 2-Hydroxybenzoate PubChem CID: 6874 IUPAC Name: 3-methylbutyl 2-hydroxybenzoate SMILES: CC(C)CCOC(=O)C1=CC=CC=C1O

PubChem CID 6874
CAS 87-20-7
Molecular Weight (g/mol) 208.257
MDL Number MFCD00020037
SMILES CC(C)CCOC(=O)C1=CC=CC=C1O
Synonym Isopentyl Salicylate, Salicylic Acid Isoamyl Ester, Isopentyl 2-Hydroxybenzoate
IUPAC Name 3-methylbutyl 2-hydroxybenzoate
InChI Key PMGCQNGBLMMXEW-UHFFFAOYSA-N
Molecular Formula C12H16O3
6,235

Butyl Benzoate 99.0+%, TCI America™

CAS: 136-60-7 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.23 MDL Number: MFCD00009439 InChI Key: XSIFPSYPOVKYCO-UHFFFAOYSA-N Synonym: n-butyl benzoate,benzoic acid, butyl ester,anthrapole az,benzoic acid butyl ester,dai cari xbn,benzoic acid n-butyl ester,butylester kyseliny benzoove,butylbenzoate,unii-1tgz0d0o8i,butylester kyseliny benzoove czech PubChem CID: 8698 IUPAC Name: butyl benzoate SMILES: CCCCOC(=O)C1=CC=CC=C1

PubChem CID 8698
CAS 136-60-7
Molecular Weight (g/mol) 178.23
MDL Number MFCD00009439
SMILES CCCCOC(=O)C1=CC=CC=C1
Synonym n-butyl benzoate,benzoic acid, butyl ester,anthrapole az,benzoic acid butyl ester,dai cari xbn,benzoic acid n-butyl ester,butylester kyseliny benzoove,butylbenzoate,unii-1tgz0d0o8i,butylester kyseliny benzoove czech
IUPAC Name butyl benzoate
InChI Key XSIFPSYPOVKYCO-UHFFFAOYSA-N
Molecular Formula C11H14O2
6,236

4-Iodobenzotrifluoride (stabilized with Copper chip) 97.0+%, TCI America™

CAS: 455-13-0 Molecular Formula: C7H4F3I Molecular Weight (g/mol): 272.009 MDL Number: MFCD00039398 InChI Key: SKGRFPGOGCHDPC-UHFFFAOYSA-N Synonym: 4-iodobenzotrifluoride,1-iodo-4-trifluoromethyl benzene,p-iodobenzotrifluoride,benzene, 1-iodo-4-trifluoromethyl,4-trifluoromethyl iodobenzene,4-iodo-alpha,alpha,alpha-trifluorotoluene,alpha,alpha,alpha-trifluoro-4-iodotoluene,4-iodobenztrifluoride,4-iodobenzo trifluoride,4-iodo-1-trifluoromethylbenzene PubChem CID: 67993 IUPAC Name: 1-iodo-4-(trifluoromethyl)benzene SMILES: C1=CC(=CC=C1C(F)(F)F)I

PubChem CID 67993
CAS 455-13-0
Molecular Weight (g/mol) 272.009
MDL Number MFCD00039398
SMILES C1=CC(=CC=C1C(F)(F)F)I
Synonym 4-iodobenzotrifluoride,1-iodo-4-trifluoromethyl benzene,p-iodobenzotrifluoride,benzene, 1-iodo-4-trifluoromethyl,4-trifluoromethyl iodobenzene,4-iodo-alpha,alpha,alpha-trifluorotoluene,alpha,alpha,alpha-trifluoro-4-iodotoluene,4-iodobenztrifluoride,4-iodobenzo trifluoride,4-iodo-1-trifluoromethylbenzene
IUPAC Name 1-iodo-4-(trifluoromethyl)benzene
InChI Key SKGRFPGOGCHDPC-UHFFFAOYSA-N
Molecular Formula C7H4F3I
6,237

4-(Methylthio)toluene 98.0+%, TCI America™

CAS: 623-13-2 Molecular Formula: C8H10S Molecular Weight (g/mol): 138.23 MDL Number: MFCD00008560 InChI Key: VHILIAIEEYLJNA-UHFFFAOYSA-N Synonym: methyl p-tolyl sulfide,4-methylthioanisole,4-methylthio toluene,p-methylthio toluene,benzene, 1-methyl-4-methylthio,p-tolyl methyl sulfide,p-methylphenyl methyl sulfide,methyl p-cresyl sulfide,p-cresyl methyl sulfide PubChem CID: 69334 IUPAC Name: 1-methyl-4-(methylsulfanyl)benzene SMILES: CSC1=CC=C(C)C=C1

PubChem CID 69334
CAS 623-13-2
Molecular Weight (g/mol) 138.23
MDL Number MFCD00008560
SMILES CSC1=CC=C(C)C=C1
Synonym methyl p-tolyl sulfide,4-methylthioanisole,4-methylthio toluene,p-methylthio toluene,benzene, 1-methyl-4-methylthio,p-tolyl methyl sulfide,p-methylphenyl methyl sulfide,methyl p-cresyl sulfide,p-cresyl methyl sulfide
IUPAC Name 1-methyl-4-(methylsulfanyl)benzene
InChI Key VHILIAIEEYLJNA-UHFFFAOYSA-N
Molecular Formula C8H10S
6,238

m-Cresol 98.0+%, TCI America™

CAS: 108-39-4 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00002302 InChI Key: RLSSMJSEOOYNOY-UHFFFAOYSA-N Synonym: m-cresol,metacresol,meta-cresol,phenol, 3-methyl,3-hydroxytoluene,m-methylphenol,3-cresol,m-kresol,m-oxytoluene,m-toluol PubChem CID: 342 ChEBI: CHEBI:17231 IUPAC Name: 3-methylphenol SMILES: CC1=CC(=CC=C1)O

PubChem CID 342
CAS 108-39-4
Molecular Weight (g/mol) 108.14
ChEBI CHEBI:17231
MDL Number MFCD00002302
SMILES CC1=CC(=CC=C1)O
Synonym m-cresol,metacresol,meta-cresol,phenol, 3-methyl,3-hydroxytoluene,m-methylphenol,3-cresol,m-kresol,m-oxytoluene,m-toluol
IUPAC Name 3-methylphenol
InChI Key RLSSMJSEOOYNOY-UHFFFAOYSA-N
Molecular Formula C7H8O
6,239

4-Hydroxymethylbenzoic Acid 98.0+%, TCI America™

CAS: 3006-96-0 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00017598 InChI Key: WWYFPDXEIFBNKE-UHFFFAOYSA-N Synonym: 4-hydroxymethyl benzoic acid,4-hydroxythylbenzoic acid,unii-9z28l8sthd,hmba linker,4-hydroxymethyl-benzoic acid,benzoic acid, 4-hydroxymethyl,p-hydroxymethyl benzoic acid,4-hydroxymethyl benzoicacid,9z28l8sthd PubChem CID: 76360 IUPAC Name: 4-(hydroxymethyl)benzoic acid SMILES: OCC1=CC=C(C=C1)C(O)=O

PubChem CID 76360
CAS 3006-96-0
Molecular Weight (g/mol) 152.15
MDL Number MFCD00017598
SMILES OCC1=CC=C(C=C1)C(O)=O
Synonym 4-hydroxymethyl benzoic acid,4-hydroxythylbenzoic acid,unii-9z28l8sthd,hmba linker,4-hydroxymethyl-benzoic acid,benzoic acid, 4-hydroxymethyl,p-hydroxymethyl benzoic acid,4-hydroxymethyl benzoicacid,9z28l8sthd
IUPAC Name 4-(hydroxymethyl)benzoic acid
InChI Key WWYFPDXEIFBNKE-UHFFFAOYSA-N
Molecular Formula C8H8O3
6,240

Pterostilbene 98.0+%, TCI America™

CAS: 537-42-8 Molecular Formula: C16H16O3 Molecular Weight (g/mol): 256.301 MDL Number: MFCD00238710 InChI Key: VLEUZFDZJKSGMX-ONEGZZNKSA-N Synonym: 4′C-Hydroxy-3,5-dimethoxy-trans-stilbene, trans-1-(3,5-Dimethoxyphenyl)-2-(4-hydroxyphenyl)ethylene PubChem CID: 5281727 ChEBI: CHEBI:8630 IUPAC Name: 4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]phenol SMILES: COC1=CC(=CC(=C1)C=CC2=CC=C(C=C2)O)OC

PubChem CID 5281727
CAS 537-42-8
Molecular Weight (g/mol) 256.301
ChEBI CHEBI:8630
MDL Number MFCD00238710
SMILES COC1=CC(=CC(=C1)C=CC2=CC=C(C=C2)O)OC
Synonym 4′C-Hydroxy-3,5-dimethoxy-trans-stilbene, trans-1-(3,5-Dimethoxyphenyl)-2-(4-hydroxyphenyl)ethylene
IUPAC Name 4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]phenol
InChI Key VLEUZFDZJKSGMX-ONEGZZNKSA-N
Molecular Formula C16H16O3