CAS
98974-89-1 Purity
96%
98974-89-1 Purity
96%
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Specification
The molecular formula is C10H6S2.
It was first created on March 27, 2005, and last modified on December 30, 2023.
The IUPAC name is 2,3-dithiatricyclo[6.3.1.0 4,12]dodeca-1(11),4,6,8(12),9-pentaene.
The InChIKey is NDOFGUDEKQECDN-UHFFFAOYSA-N.
It has 2 hydrogen bond acceptors.
The exact mass is 189.99109254 g/mol.
There are 12 heavy atoms.
No, it does not have any defined atom or bond stereocenters.
The topological polar surface area is 50.6 Ų.
Yes, the compound is canonicalized.