5-Thiazolecarboxylic acid, 2-amino-4-methyl-, methyl ester


Chemical Name: 5-Thiazolecarboxylic acid, 2-amino-4-methyl-, methyl ester
CAS Number: 3829-80-9
Product Number: AG003RMS(AGN-PC-0JVBQH)
Synonyms:
MDL No:
Molecular Formula: C6H8N2O2S
Molecular Weight: 172.2049

Identification/Properties


Properties
MP:
171-174 °C
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
172.202g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
172.031g/mol
Monoisotopic Mass:
172.031g/mol
Topological Polar Surface Area:
93.4A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
165
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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