methyl 6-​cyanopyridazine-​3-​carboxylate


Chemical Name: methyl 6-​cyanopyridazine-​3-​carboxylate
CAS Number: 1523617-81-3
Product Number: AG00HY0Q(AGN-PC-0WALAB)
Synonyms:
MDL No:
Molecular Formula: C7H5N3O2
Molecular Weight: 163.1335

Identification/Properties


Computed Properties
Molecular Weight:
163.136g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
163.038g/mol
Monoisotopic Mass:
163.038g/mol
Topological Polar Surface Area:
75.9A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
220
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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