1,6-BIS(VINYLOXY)HEXANE

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Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID40941524

Structure

InChI Key JOSFJABFAXRZJQ-UHFFFAOYSA-N
Smiles O(C=C)CCCCCCOC=C
InChI
InChI=1/C10H18O2/c1-3-11-9-7-5-6-8-10-12-4-2/h3-4H,1-2,5-10H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H18O2
Molecular Weight 170.13
AlogP 2.87
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 9.0
Polar Surface Area 18.46
Heavy Atoms 12.0

Cross References

Resources Reference
CAS NUMBER 19763-13-4
NORMAN SUSDAT
PubChem 88229
CONTENTS