2-Benzothiazolecarboxylic acid, ethyl ester


Chemical Name: 2-Benzothiazolecarboxylic acid, ethyl ester
CAS Number: 32137-76-1
Product Number: AG00BZR7(AGN-PC-0JU7EF)
Synonyms:
MDL No: MFCD00848360
Molecular Formula: C10H9NO2S
Molecular Weight: 207.2490

Identification/Properties


Properties
MP:
66-68 °C
BP:
312.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
207.247g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
207.035g/mol
Monoisotopic Mass:
207.035g/mol
Topological Polar Surface Area:
67.4A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
222
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


NMR Spectrum


Other Analytical Data


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