Estragole
Properties
- Molecular formula
- C10H12O
- Molar mass
- 148.20 g/mol
- Exact mass
- 148.0888 Da
- Density
- 0.9645 g/mL (at 21 °C)
- Melting point
- 28–35 °C
- Boiling point
- 215.5 °C
- logP
- 2.42Crippen estimate
- Polar surface area
- 9.2 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 3
Identifiers
CAS number
140-67-0SMILES
C=CCc1ccc(OC)cc1InChIKey
ZFMSMUAANRJZFM-UHFFFAOYSA-NInChI
InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
31 names · show all
- Benzene, 1-methoxy-4-(2-propen-1-yl)-
- Anisole, p-allyl-
- Benzene, 1-methoxy-4-(2-propenyl)-
- Ether, p-allylphenyl methyl
- 1-Methoxy-4-(2-propen-1-yl)benzene
- p-Allylanisole
- Chavicol methyl ether
- Esdragol
- Esdragon
- Isoanethole
- p-Methoxyallylbenzene
- Methyl chavicol
- Chavicol, O-methyl-
- Esdragole
- 4-Methoxyallylbenzene
- 4-Allylanisole
- 3-(p-Methoxyphenyl)propene
- Estragol
- 4-Allylmethoxybenzene
- 1-Allyl-4-methoxybenzene
- Chavicol, methyl-
- 1-Methoxy-4-(2-propenyl)benzene
- p-Allylphenyl methyl ether
- 3-(p-Methoxyphenyl)-1-propene
- 3-(4-Methoxyphenyl)-1-propene
- NSC 404113
- O-Methylchavicol
- Estragenole
- AUSTL 21320
- Esteragol
- 3-(4-Methoxyphenyl)propene
Work with Estragole
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
Methyl eugenol93-15-259 % similar
Eugenol97-53-053 % similar
1-Ethyl-4-methoxybenzene1515-95-352 % similar
Elemicin487-11-652 % similar
4-Propylanisole104-45-050 % similar
Anisyl alcohol105-13-550 % similar
1,4-Dimethoxybenzene150-78-750 % similar
Bis(4-methoxybenzyl)amine17061-62-050 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds