2H-1,4-Benzothiazin-3(4H)-one, 6-(chloroacetyl)-


Chemical Name: 2H-1,4-Benzothiazin-3(4H)-one, 6-(chloroacetyl)-
CAS Number: 145736-61-4
Product Number: AG001DD9(AGN-PC-00UQTP)
Synonyms:
MDL No:
Molecular Formula: C10H8ClNO2S
Molecular Weight: 241.6940

Identification/Properties


Properties
MP:
219-224℃
Form:
Solid
Computed Properties
Molecular Weight:
241.689g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
240.996g/mol
Monoisotopic Mass:
240.996g/mol
Topological Polar Surface Area:
71.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
285
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
1759
Hazard Statements:
H314-H317
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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