Home Carboxys 3-Pyridazinecarboxylic acid, 1,6-dihydro-1-Methyl-6-oxo-, Methyl ester

3-Pyridazinecarboxylic acid, 1,6-dihydro-1-Methyl-6-oxo-, Methyl ester

CAS No.:
74173-58-3
Catalog Number:
AG00FWML
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
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Product Description
Catalog Number:
AG00FWML
Chemical Name:
3-Pyridazinecarboxylic acid, 1,6-dihydro-1-Methyl-6-oxo-, Methyl ester
CAS Number:
74173-58-3
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
MDL Number:
MFCD23716634
IUPAC Name:
methyl 1-methyl-6-oxopyridazine-3-carboxylate
InChI:
InChI=1S/C7H8N2O3/c1-9-6(10)4-3-5(8-9)7(11)12-2/h3-4H,1-2H3
InChI Key:
MLOCOCULIFZPTB-UHFFFAOYSA-N
SMILES:
Cn1nc(ccc1=O)C(=O)OC
Properties
Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.053g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.152g/mol
Monoisotopic Mass:
168.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties