Keyword(s): Human Metabolites
Molecule Category Free-form
UNII EM57JSM2Y9
EPA CompTox DTXSID3063542

Structure

InChI Key SEDZOYHHAIAQIW-UHFFFAOYSA-N
Smiles [N-]=[N+]=N[Si](C)(C)C
InChI
InChI=1/C3H9N3Si/c1-7(2,3)6-5-4/h1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C3H10N3Si
Molecular Weight 115.06
AlogP 2.13
Hydrogen Bond Acceptor 1.0
Number of Rotational Bond 1.0
Polar Surface Area 48.76
Heavy Atoms 7.0

Cross References

Resources Reference
CAS NUMBER 4648-54-8
NORMAN SUSDAT
FDA SRS EM57JSM2Y9