methyl 2-chloro-1,3-thiazole-4-carboxylate


Chemical Name: methyl 2-chloro-1,3-thiazole-4-carboxylate
CAS Number: 850429-61-7
Product Number: AG0036DM(AGN-PC-0LXPD8)
Synonyms:
MDL No:
Molecular Formula: C5H4ClNO2S
Molecular Weight: 177.6088

Identification/Properties


Properties
MP:
90-94°C
BP:
271.2°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
177.602g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
176.965g/mol
Monoisotopic Mass:
176.965g/mol
Topological Polar Surface Area:
67.4A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
144
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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