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80866-94-0

80866-94-0 structural image
Product Name: 3,5-DINITRO-2-METHYLBENZYL ALCOHOL
Formula: C8H8N2O5
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COMPUTED DESCRIPTORS

Molecular Weight 212.16 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 212.04332136 g/mol
Monoisotopic Mass 212.04332136 g/mol
Topological Polar Surface Area 112 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 259
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