Nom: Pyridine-3,5-dicarboxylic acid dimethyl ester
SMILES:
COC(=O)c1cncc(C(=O)OC)c1Molecular Processing
Molecular formula
C9H9NO4
Molecular weight
195.17
Exact mass
195.0532
XLogP
0.65
TPSA
65.49
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
46.92
Supplementary Information
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