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1242095-23-3

1242095-23-3 structural image
Product Name: N-([4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]SULFONYL)VALINE
Formula: C12H13ClF3NO4S
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COMPUTED DESCRIPTORS

Molecular Weight 359.75 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 5
Exact Mass 359.0205912 g/mol
Monoisotopic Mass 359.0205912 g/mol
Topological Polar Surface Area 91.8 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 504
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