(E)-DODEC-10-ENYL ACETATE

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

Structure

InChI Key JARZGLPTLYDJAG-ONEGZZNKSA-N
Smiles O=C(OCCCCCCCCCC=CC)C
InChI
InChI=1/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14(2)15/h3-4H,5-13H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H26O2
Molecular Weight 226.19
AlogP 4.25
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 10.0
Polar Surface Area 26.3
Heavy Atoms 16.0

Cross References

Resources Reference
CAS NUMBER 35153-09-4
NORMAN SUSDAT
PubChem 5352401
CONTENTS