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21651-04-7

21651-04-7 structural image
Product Name: 3-hydroxy-2,2-dimethylpropyl 4-methylbenzenesulfonate
Formula: C12H18O4S
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COMPUTED DESCRIPTORS

Molecular Weight 258.34 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 258.09258022 g/mol
Monoisotopic Mass 258.09258022 g/mol
Topological Polar Surface Area 72 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 321
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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