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893611-87-5

893611-87-5 structural image
Product Name: 2-(3-METHYL-PIPERAZIN-1-YL)-3-NITRO-BENZOIC ACID
Formula: C12H15N3O4
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COMPUTED DESCRIPTORS

Molecular Weight 265.26 g/mol
XLogP3 -1.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 2
Exact Mass 265.10625597 g/mol
Monoisotopic Mass 265.10625597 g/mol
Topological Polar Surface Area 98.4 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 357
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