(2S)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxylic acid


Chemical Name: (2S)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxylic acid
CAS Number: 272437-85-1
Product Number: AG00I55S(AGN-PC-0JWJI4)
Synonyms:
MDL No: MFCD03001420
Molecular Formula: C10H9NO3S
Molecular Weight: 223.2484

Identification/Properties


Computed Properties
Molecular Weight:
223.246g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
223.03g/mol
Monoisotopic Mass:
223.03g/mol
Topological Polar Surface Area:
91.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
294
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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