P-BIPHENYLYL N-METHYLCARBAMATE

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

Structure

InChI Key XZGFMHRLEMUFDK-UHFFFAOYSA-N
Smiles CNC(=O)Oc1ccc(cc1)c2ccccc2
InChI
InChI=1S/C14H13NO2/c1-15-14(16)17-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3,(H,15,16)

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H13N1O2
Molecular Weight 227.09
AlogP 3.28
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 41.82
Heavy Atoms 17.0

Cross References

Resources Reference
CAS NUMBER 5579-05-5
NORMAN SUSDAT
CONTENTS