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939760-99-3

939760-99-3 structural image
Product Name: 1-(4-NITRO-BENZYLAMINO)-CYCLOHEXANECARBOXYLIC ACID HYDROCHLORIDE
Formula: C14H18N2O4
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COMPUTED DESCRIPTORS

Molecular Weight 314.76 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 314.1033348 g/mol
Monoisotopic Mass 314.1033348 g/mol
Topological Polar Surface Area 95.2 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 353
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 2
Compound Is Canonicalized Yes