Methyl N-(diphenylmethylidene)glycinate

C₁₆H₁₅NO₂CAS 81167-39-7253.30 g/mol

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Properties

Molecular formula: C₁₆H₁₅NO₂
Molar mass: 253.30 g/mol
Exact mass: 253.1103 Da
logP: 2.70Crippen estimate
Polar surface area: 38.7 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

81167-39-7

SMILES

COC(=O)CN=C(C1=CC=CC=C1)C2=CC=CC=C2

InChIKey

PQTOLHHWLUCKSB-UHFFFAOYSA-N

InChI

InChI=1S/C16H15NO2/c1-19-15(18)12-17-16(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,12H2,1H3

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Names and synonyms

1 names

N-(Diphenylmethylene)glycine methyl ester

Work with Methyl N-(diphenylmethylidene)glycinate

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

N-(Diphenylmethylene)glycine ethyl ester69555-14-267 % similar N-(Diphenylmethylene)glycine tert-butyl ester81477-94-365 % similar N-Benzyloxycarbonylglycine methyl ester1212-53-955 % similar Methyl 3-benzoylpropionate25333-24-854 % similar Azlactone1199-01-553 % similar Methyl phenylacetate101-41-751 % similar Methyl 3-phenylpropionate103-25-350 % similar Methyl 2-phenoxyacetate2065-23-849 % similar

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

Same formula

N-(Cinnamoyl)-3-methoxyaniline127033-74-3 (5S,6R)-5,6-Diphenyl-2-morpholinone144538-22-7 4-Benzyloxy-3-methoxyphenylacetonitrile1700-29-4 (5R,6S)-5,6-Diphenyl-2-morpholinone282735-66-4 5,6-Dimethoxy-2-phenylindole62663-26-7

Elsewhere

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