(R)-ETHYL N-FORMYL-N-(1-PHENYLETHYL)GLYCINE

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Keyword(s): Human Metabolites
Molecule Category Free-form

Structure

InChI Key BVWIZXLFJOXRPR-UHFFFAOYSA-N
Smiles CCC(N(C=O)C(C)c1ccccc1)C(O)=O
InChI
InChI=1S/C13H17NO3/c1-3-12(13(16)17)14(9-15)10(2)11-7-5-4-6-8-11/h4-10,12H,3H2,1-2H3,(H,16,17)

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H17N1O3
Molecular Weight 235.12
AlogP 2.07
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 6.0
Polar Surface Area 57.61
Heavy Atoms 17.0

Cross References

Resources Reference
CAS NUMBER 66514-85-0
NORMAN SUSDAT
CONTENTS