CAS
245-08-9 Purity
>98.0%(HPLC)
245-08-9 Purity
>98.0%(HPLC)
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Specification
The molecular formula is C9H12O2S.
The molecular weight is 184.26 g/mol.
The IUPAC name is 3,3-dimethyl-2,4-dihydrothieno[3,4-b][1,4]dioxepine.
The InChIKey is PUEUIEYRIVFGLS-UHFFFAOYSA-N.
The compound has 3 hydrogen bond acceptor counts.
The exact mass is 184.05580079 g/mol.
There are 12 heavy atoms present in the compound.
No, the compound does not have any defined atom or bond stereocenters.
The topological polar surface area is 46.7 Ų.
Yes, the compound is canonicalized.