2-[(2-Chlorobenzyl)oxy]benzaldehyde

C₁₄H₁₁ClO₂CAS 53389-99-4246.69 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Ether

Properties

Molecular formula: C₁₄H₁₁ClO₂
Molar mass: 246.69 g/mol
Exact mass: 246.0448 Da
logP: 3.73Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 4

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 2 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

53389-99-4

SMILES

C1=CC=C(C(=C1)COC2=CC=CC=C2C=O)Cl

InChIKey

DNLXVAPVRJZHFU-UHFFFAOYSA-N

InChI

InChI=1S/C14H11ClO2/c15-13-7-3-1-6-12(13)10-17-14-8-4-2-5-11(14)9-16/h1-9H,10H2

Weigh it out

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

Names and synonyms

1 names

2-(2-Chlorobenzyloxy)benzaldehyde

Work with 2-[(2-Chlorobenzyl)oxy]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

2-(Benzyloxy)benzaldehyde5896-17-359 % similar 2-Chlorobenzaldehyde89-98-553 % similar 2-Ethoxybenzaldehyde613-69-453 % similar 2-(2-Hydroxyethoxy)benzaldehyde22042-72-450 % similar 2-(Allyloxy)benzaldehyde28752-82-150 % similar 2-Propoxy-benzaldehyde7091-12-550 % similar (2-Formylphenoxy)acetic acid6280-80-447 % similar 2,3-Dichlorobenzaldehyde6334-18-546 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-(Benzyloxy)benzoyl chloride1486-50-6

Elsewhere

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