2H-1,4-Benzothiazin-3(4H)-one, 7-bromo-


Chemical Name: 2H-1,4-Benzothiazin-3(4H)-one, 7-bromo-
CAS Number: 90814-91-8
Product Number: AG003NDL(AGN-PC-0JUYX8)
Synonyms:
MDL No:
Molecular Formula: C8H6BrNOS
Molecular Weight: 244.1083

Identification/Properties


Properties
MP:
210-214 °C(lit.)
BP:
397.2°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
244.106g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
242.935g/mol
Monoisotopic Mass:
242.935g/mol
Topological Polar Surface Area:
54.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
200
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:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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