CAS
94200-73-4 Purity
96%
94200-73-4 Purity
96%
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The molecular formula is C12H14O4S2.
The molecular weight is 286.4 g/mol.
The IUPAC name is 1,5-bis(ethenylsulfonyl)-2,4-dimethylbenzene.
The InChI is InChI=1S/C12H14O4S2/c1-5-17(13,14)11-8-12(18(15,16)6-2)10(4)7-9(11)3/h5-8H,1-2H2,3-4H3.
The InChIKey is BGZJIFCQZFIYJP-UHFFFAOYSA-N.
It has 4 hydrogen bond acceptor counts.
The topological polar surface area is 85 Å2.
It has 4 rotatable bond counts.
Yes, it is a canonicalized compound.
The PubChem CID is 3023966.