5-Thiazolecarboxylic acid, 2-methyl-, ethyl ester


Chemical Name: 5-Thiazolecarboxylic acid, 2-methyl-, ethyl ester
CAS Number: 79836-78-5
Product Number: AG005GQX(AGN-PC-0CDWX9)
Synonyms:
MDL No:
Molecular Formula: C7H9NO2S
Molecular Weight: 171.2169

Identification/Properties


Properties
BP:
242.127 °C at 760 mmHg
Storage:
2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
171.214g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
171.035g/mol
Monoisotopic Mass:
171.035g/mol
Topological Polar Surface Area:
67.4A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
151
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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