N-NITROSOBIS(2-OXOPROPYL)AMINE

/static/temp/default.svg Search structure
Keyword(s): Human Metabolites
Molecule Category Free-form
UNII H5C28SA7UB

Structure

InChI Key AKRYBBWYDSDZHG-UHFFFAOYSA-N
Smiles CC(=O)CN(CC(C)=O)N=O
InChI
InChI=1S/C6H10N2O3/c1-5(9)3-8(7-11)4-6(2)10/h3-4H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H10N2O3
Molecular Weight 158.07
AlogP 0.15
Hydrogen Bond Acceptor 4.0
Number of Rotational Bond 5.0
Polar Surface Area 66.81
Heavy Atoms 11.0

Cross References

Resources Reference
CAS NUMBER 60599-38-4
NORMAN SUSDAT
FDA SRS H5C28SA7UB
CONTENTS