4-Thiazolecarboxylic acid, 2-formyl-, ethyl ester


Chemical Name: 4-Thiazolecarboxylic acid, 2-formyl-, ethyl ester
CAS Number: 73956-17-9
Product Number: AG005AGK(AGN-PC-007G8Y)
Synonyms:
MDL No:
Molecular Formula: C7H7NO3S
Molecular Weight: 185.2004

Identification/Properties


Properties
MP:
64.3-65.6℃(Solv: ligroine (8032-32-4))
BP:
311.6°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
185.197g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
185.015g/mol
Monoisotopic Mass:
185.015g/mol
Topological Polar Surface Area:
84.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
186
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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