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31846-46-5 | 3,4-Dihydro-3-isopropyl-4-oxo-1H-2,3-benzothiazine 2,2-dioxide
CAS No: 31846-46-5 Catalog No: AG00CUNC MDL No:
Product Description
Catalog Number:
AG00CUNC
Chemical Name:
3,4-Dihydro-3-isopropyl-4-oxo-1H-2,3-benzothiazine 2,2-dioxide
CAS Number:
31846-46-5
IUPAC Name:
2,2-dioxo-3-propan-2-yl-1H-2λ6,3-benzothiazin-4-one
InChI:
InChI=1S/C11H13NO3S/c1-8(2)12-11(13)10-6-4-3-5-9(10)7-16(12,14)15/h3-6,8H,7H2,1-2H3
InChI Key:
JIQOPFIEDZPLQT-UHFFFAOYSA-N
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.062g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.289g/mol
Monoisotopic Mass:
239.062g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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