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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.
Anthracenes (2)
Dibenzocycloheptenes (7)
Fluorenes (13)
Indanes (3)
Naphthalenes (26)
Phenanthrenes and derivatives (2)
Phenol esters (1)
Pyrenes (2)
Tetralins (4)
Triphenyl compounds (2)
Unsubstituted Phenols (20)
Benzene and substituted derivatives (486)
Phenols (27)

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Keyword Search:
1 – 15 of 255 results
1

Cinnamaldoxime, (E)+(Z), 98%

CAS: 13372-81-1 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 MDL Number: MFCD00019969 InChI Key: RUQDOYIAKHIMAN-DAAQNPAKSA-N Synonym: cinnamaldehyde oxime,3-phenylacrylaldehyde oxime,phenylacrylaldehyde oxime,e-n-2e-3-phenylprop-2-en-1-ylidene hydroxylamine,n-hydroxy-3-phenylprop-2-en-1-imine,n-3-phenylprop-2-en-1-ylidene hydroxylamine,3-phenylpropenal oxime,benzeneacrylaldehydeoxime,3-phenyl-2-propenal oxime,cinnamaldoxime, e + z PubChem CID: 9561350 IUPAC Name: (NE)-N-[(E)-3-phenylprop-2-enylidene]hydroxylamine SMILES: O\N=C\C=C\C1=CC=CC=C1

PubChem CID 9561350
CAS 13372-81-1
Molecular Weight (g/mol) 147.18
MDL Number MFCD00019969
SMILES O\N=C\C=C\C1=CC=CC=C1
Synonym cinnamaldehyde oxime,3-phenylacrylaldehyde oxime,phenylacrylaldehyde oxime,e-n-2e-3-phenylprop-2-en-1-ylidene hydroxylamine,n-hydroxy-3-phenylprop-2-en-1-imine,n-3-phenylprop-2-en-1-ylidene hydroxylamine,3-phenylpropenal oxime,benzeneacrylaldehydeoxime,3-phenyl-2-propenal oxime,cinnamaldoxime, e + z
IUPAC Name (NE)-N-[(E)-3-phenylprop-2-enylidene]hydroxylamine
InChI Key RUQDOYIAKHIMAN-DAAQNPAKSA-N
Molecular Formula C9H9NO
2

(E)-alpha-Methylstilbene, 98%

CAS: 833-81-8 Molecular Formula: C15H14 Molecular Weight (g/mol): 194.277 MDL Number: MFCD00026343 InChI Key: OVZXISBUYCEVEV-OUKQBFOZSA-N Synonym: 1,2-diphenylpropene,e-alpha-methylstilbene,.alpha.-methylstilbene,1,2-diphenyl-1-propene,1-methyl-1,2-diphenylethene,stilbene, .alpha.-methyl,1-propene, 1,2-diphenyl,1-methyl-2-phenylvinyl benzene,trans-alpha-methylstilbene,chembl14773 PubChem CID: 1549166 IUPAC Name: [(E)-1-phenylprop-1-en-2-yl]benzene SMILES: CC(=CC1=CC=CC=C1)C2=CC=CC=C2

PubChem CID 1549166
CAS 833-81-8
Molecular Weight (g/mol) 194.277
MDL Number MFCD00026343
SMILES CC(=CC1=CC=CC=C1)C2=CC=CC=C2
Synonym 1,2-diphenylpropene,e-alpha-methylstilbene,.alpha.-methylstilbene,1,2-diphenyl-1-propene,1-methyl-1,2-diphenylethene,stilbene, .alpha.-methyl,1-propene, 1,2-diphenyl,1-methyl-2-phenylvinyl benzene,trans-alpha-methylstilbene,chembl14773
IUPAC Name [(E)-1-phenylprop-1-en-2-yl]benzene
InChI Key OVZXISBUYCEVEV-OUKQBFOZSA-N
Molecular Formula C15H14
3

2-Phenyl-2-pentenal, (E)+(Z), 90+%

CAS: 3491-63-2 Molecular Formula: C11H12O Molecular Weight (g/mol): 160.216 MDL Number: MFCD00051835 InChI Key: YPAJRUMMODCONM-IZZDOVSWSA-N Synonym: 2-phenyl-2-pentenal,2z-2-phenylpent-2-enal PubChem CID: 15310469 IUPAC Name: (Z)-2-phenylpent-2-enal SMILES: CCC=C(C=O)C1=CC=CC=C1

PubChem CID 15310469
CAS 3491-63-2
Molecular Weight (g/mol) 160.216
MDL Number MFCD00051835
SMILES CCC=C(C=O)C1=CC=CC=C1
Synonym 2-phenyl-2-pentenal,2z-2-phenylpent-2-enal
IUPAC Name (Z)-2-phenylpent-2-enal
InChI Key YPAJRUMMODCONM-IZZDOVSWSA-N
Molecular Formula C11H12O
4

2-Phenyl-2-butenal, (E)+(Z), 97%

CAS: 4411-89-6 Molecular Formula: C10H10O Molecular Weight (g/mol): 146.19 MDL Number: MFCD00053158 InChI Key: DYAOGZLLMZQVHY-MBXJOHMKSA-N Synonym: 2-phenyl-2-butenal,2-phenylcrotonaldehyde,2-phenylbutenal,alpha-phenylcrotonaldehyde,unii-n8emo6yrv9,e-2-phenylbut-2-enal,2-butenal, 2-phenyl,alpha-ethylidenebenzeneacetaldehyde,n8emo6yrv9,e-2-phenyl-2-butenal PubChem CID: 6429333 IUPAC Name: (E)-2-phenylbut-2-enal SMILES: C\C=C(\C=O)C1=CC=CC=C1

PubChem CID 6429333
CAS 4411-89-6
Molecular Weight (g/mol) 146.19
MDL Number MFCD00053158
SMILES C\C=C(\C=O)C1=CC=CC=C1
Synonym 2-phenyl-2-butenal,2-phenylcrotonaldehyde,2-phenylbutenal,alpha-phenylcrotonaldehyde,unii-n8emo6yrv9,e-2-phenylbut-2-enal,2-butenal, 2-phenyl,alpha-ethylidenebenzeneacetaldehyde,n8emo6yrv9,e-2-phenyl-2-butenal
IUPAC Name (E)-2-phenylbut-2-enal
InChI Key DYAOGZLLMZQVHY-MBXJOHMKSA-N
Molecular Formula C10H10O
5

Bisphenol E, TRC

CAS: 2081-08-5 Molecular Formula: C14 H14 O2 Molecular Weight (g/mol): 214.26 Synonym: Phenol, 4,4'-ethylidenedi- (6CI,7CI,8CI),4,4'-Ethylidenebis[phenol],1,1-Bis(4-hydroxyphenyl)ethane,4,4'-Ethylidenediphenol,Bisphenol AD,Bisphenol E IUPAC Name: 4-[1-(4-hydroxyphenyl)ethyl]phenol SMILES: CC(c1ccc(O)cc1)c2ccc(O)cc2

CAS 2081-08-5
Molecular Weight (g/mol) 214.26
SMILES CC(c1ccc(O)cc1)c2ccc(O)cc2
Synonym Phenol, 4,4'-ethylidenedi- (6CI,7CI,8CI),4,4'-Ethylidenebis[phenol],1,1-Bis(4-hydroxyphenyl)ethane,4,4'-Ethylidenediphenol,Bisphenol AD,Bisphenol E
IUPAC Name 4-[1-(4-hydroxyphenyl)ethyl]phenol
Molecular Formula C14 H14 O2
6

(E)-Fluvoxamine Maleate, TRC

CAS: 61718-82-9 Molecular Formula: C15 H21 F3 N2 O2 . C4 H4 O4 Molecular Weight (g/mol): 434.41 Synonym: Fluvoxamine maleate,2-[[[(1E)-5-Methoxy-1-[4-(trifluoromethyl)phenyl]pentylidene]amino]oxy]ethanamine (Z)-butenedioate,1-Pentanone, 5-methoxy-1-[4-(trifluoromethyl)phenyl]-, O-(2-aminoethyl)oxime, (1E)-, (2Z)-2-butenedioate (1:1) (9CI, ACI),1-Pentanone, 5-methoxy-1-[4-(trifluoromethyl)phenyl]-, O-(2-aminoethyl)oxime, (E)-, (Z)-2-butenedioate (1:1) (ZCI),Avoksin,Avoxin,Depromel,DU 23000,Dumirox,Faverin,Faverin 50,Faverine,Fevarin,Floxyfral,Luvox,Maveral,MK 264,NSC 309469 IUPAC Name: (Z)-but-2-enedioic acid;2-[(E)-[5-methoxy-1-[4-(trifluoromethyl)phenyl]pentylidene]amino]oxyethanamine SMILES: COCCCC\C(=N/OCCN)\c1ccc(cc1)C(F)(F)F.OC(=O)\C=C/C(=O)O

CAS 61718-82-9
Molecular Weight (g/mol) 434.41
SMILES COCCCC\C(=N/OCCN)\c1ccc(cc1)C(F)(F)F.OC(=O)\C=C/C(=O)O
Synonym Fluvoxamine maleate,2-[[[(1E)-5-Methoxy-1-[4-(trifluoromethyl)phenyl]pentylidene]amino]oxy]ethanamine (Z)-butenedioate,1-Pentanone, 5-methoxy-1-[4-(trifluoromethyl)phenyl]-, O-(2-aminoethyl)oxime, (1E)-, (2Z)-2-butenedioate (1:1) (9CI, ACI),1-Pentanone, 5-methoxy-1-[4-(trifluoromethyl)phenyl]-, O-(2-aminoethyl)oxime, (E)-, (Z)-2-butenedioate (1:1) (ZCI),Avoksin,Avoxin,Depromel,DU 23000,Dumirox,Faverin,Faverin 50,Faverine,Fevarin,Floxyfral,Luvox,Maveral,MK 264,NSC 309469
IUPAC Name (Z)-but-2-enedioic acid;2-[(E)-[5-methoxy-1-[4-(trifluoromethyl)phenyl]pentylidene]amino]oxyethanamine
Molecular Formula C15 H21 F3 N2 O2 . C4 H4 O4
7

10-Hydroxy (E)-Amitriptyline, TRC

CAS: 64520-05-4 Molecular Formula: C20H23NO Molecular Weight (g/mol): 293.4 Synonym: (5E)-5-[3-(dimethylamino)propylidene]-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-10-ol SMILES: CN(C)CC\C=C\1/c2ccccc2CC(O)c3ccccc13

CAS 64520-05-4
Molecular Weight (g/mol) 293.4
SMILES CN(C)CC\C=C\1/c2ccccc2CC(O)c3ccccc13
Synonym (5E)-5-[3-(dimethylamino)propylidene]-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-10-ol
Molecular Formula C20H23NO
8

(E)-N-Methylcinnamylamine Hydrochloride, TRC

CAS: 116939-14-1 Molecular Formula: C10H14ClN Molecular Weight (g/mol): 183.68 Synonym: Methyl[(2E)-3-phenylprop-2-en-1-yl]amine hydrochloride IUPAC Name: (E)-N-methyl-3-phenylprop-2-en-1-amine;hydrochloride SMILES: Cl.CNC\C=C\c1ccccc1

CAS 116939-14-1
Molecular Weight (g/mol) 183.68
SMILES Cl.CNC\C=C\c1ccccc1
Synonym Methyl[(2E)-3-phenylprop-2-en-1-yl]amine hydrochloride
IUPAC Name (E)-N-methyl-3-phenylprop-2-en-1-amine;hydrochloride
Molecular Formula C10H14ClN
9

Dibenzo[e,l]pyrene, TRC

CAS: 192-51-8 Molecular Formula: C24 H14 Molecular Weight (g/mol): 302.368 Synonym: Dibenzo[fg,op]naphthacene,Dibenzo(e,l)pyrene,Dibenzo[fg,op]tetracene; SMILES: c1ccc2c(c1)c3cccc4c5ccccc5c6cccc2c6c34

CAS 192-51-8
Molecular Weight (g/mol) 302.368
SMILES c1ccc2c(c1)c3cccc4c5ccccc5c6cccc2c6c34
Synonym Dibenzo[fg,op]naphthacene,Dibenzo(e,l)pyrene,Dibenzo[fg,op]tetracene;
Molecular Formula C24 H14
10

(E)-1-Phenyl-1-butene, TRC

CAS: 1005-64-7 Molecular Formula: C10 H12 Molecular Weight (g/mol): 132.2 Synonym: (1E)-1-Buten-1-ylbenzene (ACI),1-Butene, 1-phenyl-, (E)- (8CI),Benzene, (1E)-1-butenyl- (9CI),Benzene, 1-butenyl-, (E)- (ZCI),(E)-1-Phenyl-1-butene,(E)-But-1-en-1-ylbenzene,(E)-But-1-en-1-ylbenzene,trans-1-Phenyl-1-butene,trans-β-Ethylstyrene,(E)-1-Phenyl-1-butene IUPAC Name: [(E)-but-1-enyl]benzene SMILES: CC\C=C\c1ccccc1

CAS 1005-64-7
Molecular Weight (g/mol) 132.2
SMILES CC\C=C\c1ccccc1
Synonym (1E)-1-Buten-1-ylbenzene (ACI),1-Butene, 1-phenyl-, (E)- (8CI),Benzene, (1E)-1-butenyl- (9CI),Benzene, 1-butenyl-, (E)- (ZCI),(E)-1-Phenyl-1-butene,(E)-But-1-en-1-ylbenzene,(E)-But-1-en-1-ylbenzene,trans-1-Phenyl-1-butene,trans-β-Ethylstyrene,(E)-1-Phenyl-1-butene
IUPAC Name [(E)-but-1-enyl]benzene
Molecular Formula C10 H12
11

(E/Z)-10-Hydroxydemethylnortriptyline Hydrochloride, TRC

High-purity organic molecules and analytical standards, strategically delivered worldwide to empower innovation and commercial success.

Molecular Weight (g/mol) 301.81
InChI Formula InChI=1S/C18H19NO.ClH/c19-11-5-10-15-14-7-2-1-6-13(14)12-18(20)17-9-4-3-8-16(15)17;/h1-4,6-10,18,20H,5,11-12,19H2;1H/b15-10-;
Chemical Name or Material (E/Z)-10-Hydroxydemethylnortriptyline Hydrochloride
SMILES OC1C2=C(C=CC=C2)/C(C3=CC=CC=C3C1)=C\CCN.Cl
Synonym 10-Hydroxydesmethylnortriptyline Hydrochloride,5-(3-Aminopropylidene)-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-10-ol Hydrochloride
Recommended Storage -20°C
IUPAC Name (Z)-5-(3-aminopropylidene)-10,11-dihydro-5H-dibenzo[a,d][7]annulen-10-ol hydrochloride
Molecular Formula C18H19NO . (HCl)
Formula Weight 301.61
13

4,4'-[(2-Hydroxy-1,3-propanediyl)bis(oxy)]bis-benzeneacetamide (Atenolol Impurity E), TRC

CAS: 141650-31-9 Molecular Formula: C19 H22 N2 O5 Molecular Weight (g/mol): 358.39 Synonym: 2,2'-[(2-Hydroxypropane-1,3-diyl)bis(oxy-4,1-phenylene)]diacetamide,Atenolol Imp. E (EP),Benzeneacetamide, 4,4'-[(2-hydroxy-1,3-propanediyl)bis(oxy)]bis-,4,4'-[(2-Hydroxy-1,3-propanediyl)bis(oxy)]bis[benzeneacetamide] IUPAC Name: 2-[4-[3-[4-(2-amino-2-oxoethyl)phenoxy]-2-hydroxypropoxy]phenyl]acetamide SMILES: NC(=O)Cc1ccc(OCC(O)COc2ccc(CC(=O)N)cc2)cc1

CAS 141650-31-9
Molecular Weight (g/mol) 358.39
SMILES NC(=O)Cc1ccc(OCC(O)COc2ccc(CC(=O)N)cc2)cc1
Synonym 2,2'-[(2-Hydroxypropane-1,3-diyl)bis(oxy-4,1-phenylene)]diacetamide,Atenolol Imp. E (EP),Benzeneacetamide, 4,4'-[(2-hydroxy-1,3-propanediyl)bis(oxy)]bis-,4,4'-[(2-Hydroxy-1,3-propanediyl)bis(oxy)]bis[benzeneacetamide]
IUPAC Name 2-[4-[3-[4-(2-amino-2-oxoethyl)phenoxy]-2-hydroxypropoxy]phenyl]acetamide
Molecular Formula C19 H22 N2 O5
14

(E,E)-Bisdemethoxycurcumin, MedChemExpress

MedChemExpress Bisdemethoxycurcumin(Curcumin III; Didemethoxycurcumin) is a natural derivative of curcumin with anti-inflammatory and anti-cancer activities.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 308.33
Color Orange
Physical Form Solid
Chemical Name or Material (E,E)-Bisdemethoxycurcumin
Grade Research
SMILES O=C(CC(/C=C/C1=CC=C(O)C=C1)=O)/C=C/C2=CC=C(O)C=C2.[(E)].[(E)]
For Use With (Application) Cancer-programmed cell death
Percent Purity 98.0%
CAS 33171-05-0
Solubility Information DMSO : ≥ 100 mg/mL (324.33 mM)
Synonym (E,E)-Curcumin III (E,E)-Didemethoxycurcumin
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C19H16O4
Formula Weight 308.33
15

(E)-Cardamonin, MedChemExpress

MedChemExpress (E)-Cardamonin ((E)-Cardamomin) is a novel antagonist of hTRPA1 cation channel with an IC50 of 454 nM.

ENCOMPASS ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 270.28
Color Yellow
Physical Form Solid
Chemical Name or Material (E)-Cardamonin
Grade Research
SMILES O=C(C1=C(OC)C=C(O)C=C1O)/C=C/C2=CC=CC=C2.[(E)]
For Use With (Application) Cancer-programmed cell death
Percent Purity 98.03%
CAS 19309-14-9
Solubility Information DMSO : ≥ 28 mg/mL (103.60 mM)
Health Hazard 1 H302∣H315∣H319∣H335
Synonym (E)-Cardamomin (E)-Alpinetin chalcone
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C16H14O4
Formula Weight 270.28