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118160-44-4

118160-44-4 structural image
Product Name: 2-(PHENYLSULFONYL)-1 3-CYCLOHEPTADIENE
Formula: C13H14O2S
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COMPUTED DESCRIPTORS

Molecular Weight 234.32 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 234.07145086 g/mol
Monoisotopic Mass 234.07145086 g/mol
Topological Polar Surface Area 42.5 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 379
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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