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1005576-85-1

1005576-85-1 structural image
Product Name: 2-(5-METHYL-3-NITRO-PYRAZOL-1-YL)-BUTYRIC ACID ETHYL ESTER
Formula: C10H15N3O4
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COMPUTED DESCRIPTORS

Molecular Weight 241.24 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 241.10625597 g/mol
Monoisotopic Mass 241.10625597 g/mol
Topological Polar Surface Area 89.9 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 292
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes