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545394-98-7

545394-98-7 structural image
Product Name: METHYL 1,2,3,4-TETRAHYDRO-7-NITRO-2-OXOQUINOLINE-3-CARBOXYLATE
Formula: C11H10N2O5
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COMPUTED DESCRIPTORS

Molecular Weight 250.21 g/mol
XLogP3 1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 250.05897142 g/mol
Monoisotopic Mass 250.05897142 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 378
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