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20497-95-4

20497-95-4 structural image
Product Name: METHYL 3-NITROPROPIONATE 97
Formula: C4H7NO4
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COMPUTED DESCRIPTORS

Molecular Weight 133.10 g/mol
XLogP3 -0.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 133.03750770 g/mol
Monoisotopic Mass 133.03750770 g/mol
Topological Polar Surface Area 72.1 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 116
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