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869-01-2

869-01-2 structural image
Product Name: 1-BUTYL-1-NITROSOUREA
Formula: C5H11N3O2
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CHEMICAL AND PHYSICAL PROPERTIES

Vapor Pressure 0.00527 [mmHg]
LogP log Kow = 1.04
Decomposition When heated to decomposition it emits toxic fumes of /nitrogen oxides/.
Chemical Classes Nitrogen Compounds -> Other Nitrogen Compounds

COMPUTED DESCRIPTORS

Molecular Weight 145.16 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 145.085126602 g/mol
Monoisotopic Mass 145.085126602 g/mol
Topological Polar Surface Area 75.8 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 126
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes