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306-44-5

306-44-5 structural image
Product Name: (E)-2-oxopropanal oxime
Formula: C3H5NO2
Synonyms: Isonitrosoacetone
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid; [Merck Index]
Vapor Pressure 0.2 [mmHg]
Chemical Classes Nitrogen Compounds -> Oximes

COMPUTED DESCRIPTORS

Molecular Weight 87.08 g/mol
XLogP3 0.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 87.032028402 g/mol
Monoisotopic Mass 87.032028402 g/mol
Topological Polar Surface Area 49.7 Ų
Heavy Atom Count 6
Formal Charge 0
Complexity 76.9
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes