Home Carboxys 3-Pyridazinecarboxylic acid, 5-methyl-, methyl ester

3-Pyridazinecarboxylic acid, 5-methyl-, methyl ester

CAS No.:
1788044-15-4
Catalog Number:
AG0026DG
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
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Product Description
Catalog Number:
AG0026DG
Chemical Name:
3-Pyridazinecarboxylic acid, 5-methyl-, methyl ester
CAS Number:
1788044-15-4
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
MDL Number:
MFCD29037475
IUPAC Name:
methyl 5-methylpyridazine-3-carboxylate
InChI:
InChI=1S/C7H8N2O2/c1-5-3-6(7(10)11-2)9-8-4-5/h3-4H,1-2H3
InChI Key:
BIYMLOWJVNDMKB-UHFFFAOYSA-N
SMILES:
COC(=O)c1nncc(c1)C
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.059g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.153g/mol
Monoisotopic Mass:
152.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties