1H-Pyrazole-4-carboxylic acid, 5-chloro-1-methyl-


Chemical Name: 1H-Pyrazole-4-carboxylic acid, 5-chloro-1-methyl-
CAS Number: 54367-66-7
Product Number: AG00366U(AGN-PC-0KK7C7)
Synonyms:
MDL No:
Molecular Formula: C5H5ClN2O2
Molecular Weight: 160.5584

Identification/Properties


Properties
MP:
197-198 °C
BP:
315.8°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
160.557g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
160.004g/mol
Monoisotopic Mass:
160.004g/mol
Topological Polar Surface Area:
55.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
153
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


Request for Quotation


Customer Feedback