Beta-asarone
Properties
- Molecular formula
- C12H16O3
- Molar mass
- 208.26 g/mol
- Exact mass
- 208.1099 Da
- logP
- 2.75Crippen estimate
- Polar surface area
- 27.7 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 4
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H412 Harmful to aquatic life with long lasting effects61.3% of notifiers
Aggregated from 168 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264, P270, P273, P301+P317, P330, P501
Identifiers
CAS number
5273-86-9SMILES
C/C=Cc1cc(OC)c(OC)cc1OCInChIKey
RKFAZBXYICVSKP-WAYWQWQTSA-NInChI
InChI=1S/C12H16O3/c1-5-6-9-7-11(14-3)12(15-4)8-10(9)13-2/h5-8H,1-4H3/b6-5-Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
11 names
- β-Asarone
- Benzene, 1,2,4-trimethoxy-5-(1Z)-1-propen-1-yl-
- Benzene, 1,2,4-trimethoxy-5-propenyl-, (Z)-
- Benzene, 1,2,4-trimethoxy-5-(1-propenyl)-, (Z)-
- Benzene, 1,2,4-trimethoxy-5-(1Z)-1-propenyl-
- 1,2,4-Trimethoxy-5-(1Z)-1-propen-1-ylbenzene
- cis-β-Asarone
- cis-Isoasarone
- cis-Asarone
- (Z)-Asarone
- (Z)-Azarone
Work with Beta-asarone
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
2,4,5-Trimethoxybenzaldehyde4460-86-057 % similar
Methyl isoeugenol93-16-353 % similar
3-(2,4,5-Trimethoxyphenyl)-2-propenoic acid24160-53-053 % similar
2,5-Dimethoxyterephthalaldehyde7310-97-650 % similar
2,3,6,7,10,11-Hexamethoxytriphenylene808-57-144 % similar
Isoeugenol97-54-143 % similar
6-Bromoveratraldehyde5392-10-941 % similar
2-Fluoro-4,5-dimethoxybenzaldehyde71924-62-441 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds