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444667-11-2

444667-11-2 structural image
Product Name: 4-(CARBOXYMETHYL)-3-NITROBENZOIC ACID
Formula: C9H7NO6
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COMPUTED DESCRIPTORS

Molecular Weight 225.15 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 225.02733694 g/mol
Monoisotopic Mass 225.02733694 g/mol
Topological Polar Surface Area 120 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 310
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