16229-02-0 Purity
95%+
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Specification
The molecular formula of Bethoxazin is C11H9NO2S2.
The molecular weight of Bethoxazin is 251.3 g/mol.
The IUPAC name of Bethoxazin is 3-(1-benzothiophen-2-yl)-5,6-dihydro-1,4,2-oxathiazine 4-oxide.
The InChI of Bethoxazin is InChI=1S/C11H9NO2S2/c13-16-6-5-14-12-11(16)10-7-8-3-1-2-4-9(8)15-10/h1-4,7H,5-6H2.
The InChIKey of Bethoxazin is NRAYWXLNSHEHQO-UHFFFAOYSA-N.
Some synonyms for Bethoxazin are Bethogard, DYC6660ZZ3.
The CAS number of Bethoxazin is 163269-30-5.
Bethoxazin has 5 hydrogen bond acceptor counts.
Bethoxazin has 1 rotatable bond count.
The topological polar surface area of Bethoxazin is 86.1 Ų.