N-neopentyl-N-nitrosourea

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 105
Total Number of Articles : 103
PubChem 146717
Molecular Formula

C6H13N3O2

SMILES

CC(C)(C)CN(C(=O)N)N=O

InChI

InChI=1S/C6H13N3O2/c1-6(2,3)4-9(8-11)5(7)10/h4H2,1-3H3,(H2,7,10)

synonyms
  • N-Neopentyl-N-nitrosourea
  • 22429-25-0
  • 1-(2,2-dimethylpropyl)-1-nitrosourea
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Properties
Property Value
MW 159.19 g/mol
HBD 1
HBA 3
Rotatable Bond Count 2
Exact Mass 159.100776666 g/mol
Monoisotopic Mass 159.100776666 g/mol
Heavy Atom Count 11
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 162
xlogp 1.6
Topological Polar Surface Area 75.8