4-Thiazolecarboxylic acid, 2-chloro-


Chemical Name: 4-Thiazolecarboxylic acid, 2-chloro-
CAS Number: 5198-87-8
Product Number: AG00339R(AGN-PC-03FW0Y)
Synonyms:
MDL No:
Molecular Formula: C4H2ClNO2S
Molecular Weight: 163.5822

Identification/Properties


Properties
BP:
370.208 °C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
163.575g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
162.949g/mol
Monoisotopic Mass:
162.949g/mol
Topological Polar Surface Area:
78.4A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
132
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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