Keyword(s): Human Metabolites
Molecule Category Free-form
UNII B7H99CB8S4
EPA CompTox DTXSID7068134

Structure

InChI Key HUYAEQCJNXODLQ-UHFFFAOYSA-N
Smiles COC(CN(C)C)OC
InChI
InChI=1S/C6H15NO2/c1-7(2)5-6(8-3)9-4/h6H,5H2,1-4H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H15N1O2
Molecular Weight 133.11
AlogP 0.17
Hydrogen Bond Acceptor 3.0
Number of Rotational Bond 4.0
Polar Surface Area 21.7
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 38711-20-5
NORMAN SUSDAT
FDA SRS B7H99CB8S4
PubChem 123476
ChemSpider 110072.0