2-Phenoxybenzaldehyde

C₁₃H₁₀O₂CAS 19434-34-5198.22 g/mol

Open in Covalent MOL file

Aldehyde Ether

Properties

Molecular formula: C₁₃H₁₀O₂
Molar mass: 198.22 g/mol
Exact mass: 198.0681 Da
Boiling point: 150–153 °C (at 1 Torr)
logP: 3.29Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 3

Hazards

Warning

H302 Harmful if swallowed86.4% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 44 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

19434-34-5

SMILES

O=Cc1ccccc1Oc1ccccc1

InChIKey

IMPIIVKYTNMBCD-UHFFFAOYSA-N

InChI

InChI=1S/C13H10O2/c14-10-11-6-4-5-9-13(11)15-12-7-2-1-3-8-12/h1-10H

Weigh it out

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

Names and synonyms

3 names

Benzaldehyde, 2-phenoxy-
Benzaldehyde, o-phenoxy-
o-Phenoxybenzaldehyde

Work with 2-Phenoxybenzaldehyde

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

2-Methoxybenzaldehyde135-02-457 % similar 2-(Benzyloxy)benzaldehyde5896-17-355 % similar 2-(Difluoromethoxy)benzaldehyde71653-64-053 % similar 2-(Trifluoromethoxy)benzaldehyde94651-33-953 % similar Phthalaldehyde643-79-852 % similar o-((Trimethylsilyl)oxy)benzaldehyde1078-31-552 % similar 2-Ethoxybenzaldehyde613-69-452 % similar 4-Fluoro-3-phenoxybenzaldehyde68359-57-949 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Hydroxybenzophenone1137-42-4 2-Hydroxybenzophenone117-99-7 3-Hydroxybenzophenone13020-57-0 3-(1-Naphthalenyl)-2-propenoic acid13026-12-5 3-Phenoxybenzaldehyde39515-51-0 4-Phenoxybenzaldehyde67-36-7 [1,1′-Biphenyl]-3-carboxylic acid716-76-7 Xanthydrol90-46-0

Elsewhere

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