Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID30240199

Structure

InChI Key WYLUZYJBGBMLFZ-UHFFFAOYSA-N
Smiles CCOCCN(C)CCCN(C)C
InChI
InChI=1S/C10H24N2O/c1-5-13-10-9-12(4)8-6-7-11(2)3/h5-10H2,1-4H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H24N2O1
Molecular Weight 188.19
AlogP 0.91
Hydrogen Bond Acceptor 3.0
Number of Rotational Bond 8.0
Polar Surface Area 15.71
Heavy Atoms 13.0

Cross References

Resources Reference
CAS NUMBER 94005-95-5
NORMAN SUSDAT
PubChem 3023240
ChemSpider 2289507.0