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906816-32-8

906816-32-8 structural image
Product Name: Methyl 3-Methanesulfonyl-4-Methylbenzoate
Formula: C10H12O4S
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COMPUTED DESCRIPTORS

Molecular Weight 228.27 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 228.04563003 g/mol
Monoisotopic Mass 228.04563003 g/mol
Topological Polar Surface Area 68.8 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 328
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