methyl 2-bromo-5-methyl-1,3-thiazole-4-carboxylate


Chemical Name: methyl 2-bromo-5-methyl-1,3-thiazole-4-carboxylate
CAS Number: 56355-61-4
Product Number: AG00355V(AGN-PC-03S44V)
Synonyms:
MDL No:
Molecular Formula: C6H6BrNO2S
Molecular Weight: 236.0863

Identification/Properties


Properties
BP:
271.784°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
236.083g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
234.93g/mol
Monoisotopic Mass:
234.93g/mol
Topological Polar Surface Area:
67.4A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
167
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:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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