3-(Benzyloxy)-4-methoxybenzaldehyde
Properties
- Molecular formula
- C15H14O3
- Molar mass
- 242.27 g/mol
- Exact mass
- 242.0943 Da
- Melting point
- 63 °C
- Boiling point
- 140–150 °C
- logP
- 3.09Crippen estimate
- Polar surface area
- 35.5 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 5
Identifiers
CAS number
6346-05-0SMILES
COc1ccc(C=O)cc1OCc1ccccc1InChIKey
VQVQZFHUXRSRBZ-UHFFFAOYSA-NInChI
InChI=1S/C15H14O3/c1-17-14-8-7-13(10-16)9-15(14)18-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- Benzaldehyde, 4-methoxy-3-(phenylmethoxy)-
- Benzaldehyde, 3-(benzyloxy)-4-methoxy-
- 4-Methoxy-3-(phenylmethoxy)benzaldehyde
- O-Benzylisovanillin
- Benzylisovanillin
- Isovanillin benzyl ether
- NSC 196547
- NSC 43750
- 4-Methoxy-3-benzyloxybenzaldehyde
Work with 3-(Benzyloxy)-4-methoxybenzaldehyde
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
3,4-Bis(benzyloxy)benzaldehyde5447-02-981 % similar
3-Ethoxy-4-methoxybenzaldehyde1131-52-865 % similar
Benzyl isoeugenol120-11-663 % similar
4-Ethoxy-3-methoxybenzaldehyde120-25-257 % similar
3-Benzyloxy-4-methoxybenzoic acid58452-00-955 % similar
4-(Benzyloxy)benzaldehyde4397-53-955 % similar
3-Benzyloxybenzaldehyde1700-37-455 % similar
3,5-Dibenzyloxybenzaldehyde14615-72-654 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds