6-Benzothiazolecarboxylic acid, 2,3-dihydro-2-oxo-


Chemical Name: 6-Benzothiazolecarboxylic acid, 2,3-dihydro-2-oxo-
CAS Number: 99615-68-6
Product Number: AG006NM7(AGN-PC-000G2L)
Synonyms:
MDL No:
Molecular Formula: C8H5NO3S
Molecular Weight: 195.1952

Identification/Properties


Properties
MP:
>300℃
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
195.192g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
194.999g/mol
Monoisotopic Mass:
194.999g/mol
Topological Polar Surface Area:
91.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
256
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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