ACETIC ACID, 3-ETHOXYPROPYL ESTER -

/static/temp/default.svg Search structure
Keyword(s): Food Contact Chemicals ; Plastic additives
Molecule Category Free-form
EPA CompTox DTXSID50611948

Structure

InChI Key KGQIPOITYJJHSU-UHFFFAOYSA-M
Smiles CCOC(CC)CC([O-])=O
InChI
InChI=1S/C7H14O3/c1-3-6(10-4-2)5-7(8)9/h6H,3-5H2,1-2H3,(H,8,9)/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C7H13O3
Molecular Weight 145.09
AlogP -0.06
Hydrogen Bond Acceptor 3.0
Number of Rotational Bond 5.0
Polar Surface Area 49.36
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 94825-54-4
NORMAN SUSDAT
CONTENTS