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956369-21-4

956369-21-4 structural image
Product Name: SPIRO[BICYCLO[3.3.1]NONANE-9,2'-[1,3]DITHIOLANE]-3-CARBOXYLIC ACID
Formula: C12H18O2S2
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COMPUTED DESCRIPTORS

Molecular Weight 258.4 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 258.07482216 g/mol
Monoisotopic Mass 258.07482216 g/mol
Topological Polar Surface Area 87.9 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 283
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes