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140390-04-1 | Ethanone, 1-(1,1-dioxido-4H-1,4-thiazin-4-yl)-
CAS No: 140390-04-1 Catalog No: AG001CCB MDL No:
Product Description
Catalog Number:
AG001CCB
Chemical Name:
Ethanone, 1-(1,1-dioxido-4H-1,4-thiazin-4-yl)-
CAS Number:
140390-04-1
Molecular Formula:
C6H7NO3S
Molecular Weight:
173.1897
IUPAC Name:
1-(1,1-dioxo-1,4-thiazin-4-yl)ethanone
InChI:
InChI=1S/C6H7NO3S/c1-6(8)7-2-4-11(9,10)5-3-7/h2-5H,1H3
InChI Key:
BCWGCILEMQEFNW-UHFFFAOYSA-N
SMILES:
CC(=O)N1C=CS(=O)(=O)C=C1
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.015g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.186g/mol
Monoisotopic Mass:
173.015g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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