Myristicin
Properties
- Molecular formula
- C11H12O3
- Molar mass
- 192.21 g/mol
- Exact mass
- 192.0786 Da
- Density
- 1.1437 g/mL (at 20 °C)
- Melting point
- below −20 °C
- Boiling point
- 276.5 °C
- logP
- 2.15Crippen estimate
- Polar surface area
- 27.7 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 3
Identifiers
CAS number
607-91-0SMILES
C=CCc1cc(OC)c2c(c1)OCO2InChIKey
BNWJOHGLIBDBOB-UHFFFAOYSA-NInChI
InChI=1S/C11H12O3/c1-3-4-8-5-9(12-2)11-10(6-8)13-7-14-11/h3,5-6H,1,4,7H2,2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
7 names
- 1,3-Benzodioxole, 4-methoxy-6-(2-propen-1-yl)-
- Benzene, 5-allyl-1-methoxy-2,3-(methylenedioxy)-
- 1,3-Benzodioxole, 4-methoxy-6-(2-propenyl)-
- 4-Methoxy-6-(2-propen-1-yl)-1,3-benzodioxole
- 5-Allyl-1-methoxy-2,3-(methylenedioxy)benzene
- 6-Allyl-4-methoxy-1,3-benzodioxole
- Myristicine
Work with Myristicin
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
Elemicin487-11-673 % similar
Methoxyeugenol6627-88-959 % similar
Methyl eugenol93-15-257 % similar
Safrole94-59-754 % similar
Myristicinaldehyde5780-07-454 % similar
Methyl 2-hydroxy-3-methoxy-5-(2-propen-1-yl)benzoate85614-43-345 % similar
Estragole140-67-045 % similar
Acetyleugenol93-28-745 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds