Keyword(s): Human Metabolites
Molecule Category Free-form
UNII ID1YRY20SD
EPA CompTox DTXSID90863166

Structure

InChI Key ROSFUFIOLRQOON-UHFFFAOYSA-N
Smiles O1CC(OC1C)C
InChI
InChI=1/C5H10O2/c1-4-3-6-5(2)7-4/h4-5H,3H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H10O2
Molecular Weight 102.07
AlogP 0.77
Hydrogen Bond Acceptor 2.0
Polar Surface Area 18.46
Heavy Atoms 7.0

Cross References

Resources Reference
CAS NUMBER 3390-12-3
NORMAN SUSDAT
FDA SRS ID1YRY20SD
PubChem 102993