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886364-22-3

886364-22-3 structural image
Product Name: 3-METHYL-4-NITRO-THIOBENZAMIDE
Formula: C8H8N2O2S
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COMPUTED DESCRIPTORS

Molecular Weight 196.23 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 196.03064868 g/mol
Monoisotopic Mass 196.03064868 g/mol
Topological Polar Surface Area 104 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 227
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

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