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503426-88-8

503426-88-8 structural image
Product Name: 3,5-BISNITRO-4-NEOPENTYLBENZOIC ACID
Formula: C12H14N2O6
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COMPUTED DESCRIPTORS

Molecular Weight 282.25 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 282.08518617 g/mol
Monoisotopic Mass 282.08518617 g/mol
Topological Polar Surface Area 129 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 382
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