methyl 3-chloro-6-oxo-1H-pyridazine-5-carboxylate


Chemical Name: methyl 3-chloro-6-oxo-1H-pyridazine-5-carboxylate
CAS Number: 89581-64-6
Product Number: AG003XTP(AGN-PC-0HGGMM)
Synonyms:
MDL No:
Molecular Formula: C6H5ClN2O3
Molecular Weight: 188.5685

Identification/Properties


Properties
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
188.567g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
187.999g/mol
Monoisotopic Mass:
187.999g/mol
Topological Polar Surface Area:
67.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
295
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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