CAS
96853-34-8 Purity
96%
96853-34-8 Purity
96%
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The molecular formula is C7H13NO3S.
The molecular weight is 191.25 g/mol.
It was first created on February 8, 2007.
The IUPAC name is 2-oxocycloheptane-1-sulfonamide.
The InChI is InChI=1S/C7H13NO3S/c8-12(10,11)7-5-3-1-2-4-6(7)9/h7H,1-5H2,(H2,8,10,11).
The InChIKey is VYVHBEDXEGDWNT-UHFFFAOYSA-N.
It has 1 hydrogen bond donor count.
The topological polar surface area is 85.6 Å2.
No, it has 0 defined atom stereocenter counts.
The XLogP3-AA value is 0.7.