2-(Benzyloxy)benzaldehyde

C₁₄H₁₂O₂CAS 5896-17-3212.25 g/mol

Open in Covalent MOL file

Aldehyde Ether

Properties

Molecular formula: C₁₄H₁₂O₂
Molar mass: 212.25 g/mol
Exact mass: 212.0837 Da
Melting point: 48–49 °C
Boiling point: 176–177 °C (at 4 Torr)
logP: 3.08Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 4

Hazards

Warning

H302 Harmful if swallowed66.7% of notifiers
H315 Causes skin irritation66.7% of notifiers
H319 Causes serious eye irritation66.7% of notifiers
H332 Harmful if inhaled33.3% of notifiers
H335 May cause respiratory irritation66.7% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

5896-17-3

SMILES

O=Cc1ccccc1OCc1ccccc1

InChIKey

PBEJTRAJWCNHRS-UHFFFAOYSA-N

InChI

InChI=1S/C14H12O2/c15-10-13-8-4-5-9-14(13)16-11-12-6-2-1-3-7-12/h1-10H,11H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names

Benzaldehyde, 2-(phenylmethoxy)-
Benzaldehyde, o-(benzyloxy)-
2-(Phenylmethoxy)benzaldehyde
o-(Benzyloxy)benzaldehyde
O-Benzylsalicylaldehyde
NSC 401884

Work with 2-(Benzyloxy)benzaldehyde

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

4-Benzyloxyindole-3-carboxaldehyde7042-71-964 % similar 2-Ethoxybenzaldehyde613-69-461 % similar 2-Benzyloxy-4,5-dimethoxybenzaldehyde14382-86-661 % similar 7-Benzyloxyindole-3-carbaldehyde92855-65-760 % similar 2-[(2-Chlorobenzyl)oxy]benzaldehyde53389-99-459 % similar 3,4-Bis(benzyloxy)benzaldehyde5447-02-958 % similar 4-Benzyloxy-2-methoxybenzaldehyde58026-14-557 % similar 2-(2-Hydroxyethoxy)benzaldehyde22042-72-457 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Diphenylacetic acid117-34-0 4'-Methoxy-[1,1'-biphenyl]-3-carbaldehyde118350-17-7 Benzoin (organic compound)119-53-9 Benzyl benzoate120-51-4 3-(2-Methoxyphenyl)benzaldehyde122801-57-4 3-(3-Methoxyphenyl)benzaldehyde126485-58-3 2-Hydroxy-5-methylbenzophenone1470-57-1 4'-Methylbiphenyl-3-carboxylic acid147404-69-1

Elsewhere

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