1H-Pyrazole-4-carboxaldehyde, 5-chloro-1,3-dimethyl-


Chemical Name: 1H-Pyrazole-4-carboxaldehyde, 5-chloro-1,3-dimethyl-
CAS Number: 27006-76-4
Product Number: AG00348O(AGN-PC-0KKY7F)
Synonyms:
MDL No:
Molecular Formula: C6H7ClN2O
Molecular Weight: 158.5856

Identification/Properties


Properties
MP:
78-79 °C
BP:
255.7°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
158.585g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
158.025g/mol
Monoisotopic Mass:
158.025g/mol
Topological Polar Surface Area:
34.9A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
142
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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