Keyword(s): Human Metabolites
Molecule Category Free-form
UNII GZZ9RQV8Y5
EPA CompTox DTXSID70165579

Structure

InChI Key LMDVFFHOTJYTLU-UHFFFAOYSA-N
Smiles CCOC(=O)N(C)N(C)C(=O)OCC
InChI
InChI=1S/C8H16N2O4/c1-5-13-7(11)9(3)10(4)8(12)14-6-2/h5-6H2,1-4H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H16N2O4
Molecular Weight 204.11
AlogP 1.08
Hydrogen Bond Acceptor 4.0
Number of Rotational Bond 2.0
Polar Surface Area 59.08
Heavy Atoms 14.0

Cross References

Resources Reference
CAS NUMBER 15429-36-4
NORMAN SUSDAT
FDA SRS GZZ9RQV8Y5
PubChem 84904
ChemSpider 76594.0