Structure

InChI Key LVTYICIALWPMFW-UHFFFAOYSA-N
Smiles CC(O)CNCC(C)O
InChI
InChI=1S/C6H15NO2/c1-5(8)3-7-4-6(2)9/h5-9H,3-4H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H15N1O2
Molecular Weight 133.11
AlogP -0.66
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 4.0
Polar Surface Area 52.49
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 110-97-4
NORMAN SUSDAT
FDA SRS 0W44HYL8T5
PubChem 8086
ChemSpider 7795.0