chempirical

N-Phenylglycine ethyl ester

C10H13NO2CAS 2216-92-4179.22 g/mol

Open in Covalent MOL file
OOHN
EsterSecondary amine

Properties

Molecular formula
C10H13NO2
Molar mass
179.22 g/mol
Exact mass
179.0946 Da
Melting point
58 °C
Boiling point
273.5 °C
logP
1.66Crippen estimate
Polar surface area
38.3 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
4

Identifiers

CAS number
2216-92-4
SMILES
CCOC(=O)CNc1ccccc1
InChIKey
MLSGRWDEDYJNER-UHFFFAOYSA-N
InChI
InChI=1S/C10H13NO2/c1-2-13-10(12)8-11-9-6-4-3-5-7-9/h3-7,11H,2,8H2,1H3

Weigh it out

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

Names and synonyms

6 names
  • Glycine, N-phenyl-, ethyl ester
  • Ethyl phenylglycinate
  • Ethyl N-phenylglycinate
  • Phenylglycine ethyl ester
  • Ethyl 2-(phenylamino)acetate
  • Ethyl anilinoacetate

Work with N-Phenylglycine ethyl ester

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Benzylglycine ethyl ester6436-90-462 % similar Ethyl phenylacetate101-97-357 % similar Ethyl 3-phenylpropanoate2021-28-556 % similar Ethyl 2-phenoxyacetate2555-49-954 % similar Diethyl iminodiacetate6290-05-753 % similar Ethyl oxanilate1457-85-851 % similar N-(Phenylmethyl)-β-alanine ethyl ester23583-21-351 % similar N-(Diphenylmethylene)glycine ethyl ester69555-14-250 % similar

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

Same formula

Methyl N,N-dimethylanthranilate10072-05-6 Dl-homophenylalanine1012-05-1 Phenibut1078-21-3 Dl-α-methylphenylalanine1132-26-9 3-Methylphenylalanine114926-37-3 3-Methyl-D-phenylalanine114926-39-5 4-((2-Hydroxyethyl)(methyl)amino)benzaldehyde1201-91-8 Propham122-42-9

Elsewhere

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