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157692-36-9

157692-36-9 structural image
Product Name: 7-CHLORO-2-HYDROXYMETHYL-5-NITROBENZODIOXANE
Formula: C9H8ClNO5
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COMPUTED DESCRIPTORS

Molecular Weight 245.61 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 245.0091000 g/mol
Monoisotopic Mass 245.0091000 g/mol
Topological Polar Surface Area 84.5 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 271
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