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346689-79-0

346689-79-0 structural image
Product Name: 2-METHYL-1-[(4-NITROPHENYL)SULFONYL]PIPERIDINE
Formula: C12H16N2O4S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 22.5 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 284.33 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 284.08307817 g/mol
Monoisotopic Mass 284.08307817 g/mol
Topological Polar Surface Area 91.6 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 418
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

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