chempirical

(±)-Benzoin oxime

C14H13NO2CAS 441-38-3227.26 g/mol

Open in Covalent MOL file
HONHO
AlcoholOxime

Properties

Molecular formula
C14H13NO2
Molar mass
227.26 g/mol
Exact mass
227.0946 Da
Melting point
151 °C
logP
2.60Crippen estimate
Polar surface area
52.8 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
3

Identifiers

CAS number
441-38-3
SMILES
ON=C(c1ccccc1)C(O)c1ccccc1
InChIKey
WAKHLWOJMHVUJC-UHFFFAOYSA-N
InChI
InChI=1S/C14H13NO2/c16-14(12-9-5-2-6-10-12)13(15-17)11-7-3-1-4-8-11/h1-10,14,16-17H

Weigh it out

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

Names and synonyms

8 names
  • Ethanone, 2-hydroxy-1,2-diphenyl-, oxime
  • (E)-(±)-2-Hydroxy-1,2-diphenyl-ethanone oxime
  • 2-Hydroxy-1,2-diphenylethanone oxime
  • NSC 659
  • Benzoin, oxime
  • α-Benzoin oxime
  • (±)-anti-Benzoin oxime
  • Dl-Benzoin anti-oxime

Work with (±)-Benzoin oxime

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

Benzoin (organic compound)119-53-952 % similar (±)-Benzoin579-44-252 % similar Benzohydroxamic acid495-18-148 % similar Diphenylglyoxime23873-81-647 % similar Diphenyl ketoxime574-66-347 % similar Hydroxy(phenyl)acetic acid hydrazide2443-66-544 % similar (S)-Mandelic acid17199-29-044 % similar Mandelamide4410-31-544 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2,2-Diphenylglycine3060-50-2 N-Benzylanthranilic acid6622-55-5 Benzyl anthranilate82185-41-9

Elsewhere

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