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4321-64-6

4321-64-6 structural image
Product Name: Phosphorothioic acid, O-methyl O-(3-methyl-4-nitrophenyl) ester
Formula: C8H10NO5PS
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COMPUTED DESCRIPTORS

Molecular Weight 263.21 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 263.00173059 g/mol
Monoisotopic Mass 263.00173059 g/mol
Topological Polar Surface Area 117 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 307
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