Keyword(s): Human Metabolites
Molecule Category Free-form
UNII TF7D64JK16
EPA CompTox DTXSID5074557

Structure

InChI Key XOBKSJJDNFUZPF-UHFFFAOYSA-N
Smiles CCOC
InChI
InChI=1S/C3H8O/c1-3-4-2/h3H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C3H8O1
Molecular Weight 60.06
AlogP 0.65
Hydrogen Bond Acceptor 1.0
Number of Rotational Bond 1.0
Polar Surface Area 9.23
Heavy Atoms 4.0

Cross References

Resources Reference
CAS NUMBER 540-67-0
NORMAN SUSDAT
FDA SRS TF7D64JK16
PubChem 10903
ChemSpider 10441.0