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145372-21-0

145372-21-0 structural image
Product Name: Trifluoromethyl isopropyl disulfide
Formula: C4H7F3S2
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COMPUTED DESCRIPTORS

Molecular Weight 176.2 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 175.99412706 g/mol
Monoisotopic Mass 175.99412706 g/mol
Topological Polar Surface Area 50.6 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 78.4
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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