2-Benzyloxy-4,5-dimethoxybenzaldehyde

C16H16O4CAS 14382-86-6272.30 g/mol

Open in Covalent MOL file
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AldehydeEther

Properties

Molecular formula
C16H16O4
Molar mass
272.30 g/mol
Exact mass
272.1049 Da
logP
3.10Crippen estimate
Polar surface area
44.8 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
6

Hazards

Warning
Irritant (GHS07)

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
14382-86-6
SMILES
COC1=C(C=C(C(=C1)C=O)OCC2=CC=CC=C2)OC
InChIKey
KTKIPTMZBXMHST-UHFFFAOYSA-N
InChI
InChI=1S/C16H16O4/c1-18-15-8-13(10-17)14(9-16(15)19-2)20-11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3

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Work with 2-Benzyloxy-4,5-dimethoxybenzaldehyde

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

5-(Benzyloxy)-2-bromo-4-methoxybenzaldehyde6451-86-174 % similar 4-(Benzyloxy)-3-methoxybenzaldehyde2426-87-168 % similar 4-Benzyloxy-2-methoxybenzaldehyde58026-14-567 % similar 3-(Benzyloxy)-4-methoxybenzaldehyde6346-05-064 % similar 2-(Benzyloxy)benzaldehyde5896-17-361 % similar 2,4,5-Trimethoxybenzaldehyde4460-86-060 % similar 2-Methyl 4-benzyloxybenzaldehyde101093-56-555 % similar 2,5-Dimethoxyterephthalaldehyde7310-97-654 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Loureirin C116384-24-8 4,4'-Dimethoxybenzoin119-52-8 Deoxyshikonin43043-74-9 3′-Hydroxypterostilbene475231-21-1 4-Methoxybenzoic acid 2-(4-hydroxyphenyl)ethyl ester87932-34-1

Elsewhere

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