(Z)-O-METHOXYCINNAMIC ACID

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

Structure

InChI Key FEGVSPGUHMGGBO-SREVYHEPSA-N
Smiles COc1ccccc1C=C/C(=O)O
InChI
InChI=1/C10H10O3/c1-13-9-5-3-2-4-8(9)6-7-10(11)12/h2-7H,1H3,(H,11,12)

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H10O3
Molecular Weight 178.06
AlogP 1.79
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 3.0
Polar Surface Area 46.53
Heavy Atoms 13.0

Cross References

Resources Reference
CAS NUMBER 14737-91-8
NORMAN SUSDAT
CONTENTS