4-(Benzyloxy)benzaldehyde

C14H12O2CAS 4397-53-9212.25 g/mol

Open in Covalent MOL file
OO
AldehydeEther

Properties

Molecular formula
C14H12O2
Molar mass
212.25 g/mol
Exact mass
212.0837 Da
Melting point
72 °C
Boiling point
198 °C (at 11 Torr)
logP
3.08Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
4

Hazards

Warning
Irritant (GHS07)

Aggregated from 4 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
4397-53-9
SMILES
O=Cc1ccc(OCc2ccccc2)cc1
InChIKey
ZVTWZSXLLMNMQC-UHFFFAOYSA-N
InChI
InChI=1S/C14H12O2/c15-10-12-6-8-14(9-7-12)16-11-13-4-2-1-3-5-13/h1-10H,11H2

Weigh it out

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

Names and synonyms

6 names
  • Benzaldehyde, 4-(phenylmethoxy)-
  • Benzaldehyde, p-(benzyloxy)-
  • 4-(Phenylmethoxy)benzaldehyde
  • p-(Benzyloxy)benzaldehyde
  • NSC 131669
  • NSC 28298

Work with 4-(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

3,5-Dibenzyloxybenzaldehyde14615-72-672 % similar 4-[(4-Bromophenyl)methoxy]benzaldehyde149833-95-468 % similar 3-Benzyloxybenzaldehyde1700-37-468 % similar 4-[(4-Fluorophenyl)methoxy]benzaldehyde56442-17-268 % similar Hydroquinone dibenzyl ether621-91-067 % similar 4-[(3-Fluorophenyl)methoxy]benzaldehyde66742-57-267 % similar 3,4-Bis(benzyloxy)benzaldehyde5447-02-963 % similar Benzyl phenyl ether946-80-561 % 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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