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64493-44-3

64493-44-3 structural image
Product Name: 1,7-Dicarba-closo-dodecaborane-9-yl-thiol, 9-Mercapto-1,7-dicarbadodecaborane (12)
Formula: C2H12B10S
Synonyms: 1,7-Dicarba-closo-dodecaborane-9-yl-thiol;9-Mercapto-1,7-dicarbadodecaborane (12)
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COMPUTED DESCRIPTORS

Molecular Weight 167.2 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 167.095861 g/mol
Monoisotopic Mass 169.088598 g/mol
Topological Polar Surface Area 1 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 163
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
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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