Name: ethyl 2-formyl-3-(6-methyl-3-pyridylmethyl)propionate
SMILES:
CCOC(=O)C(C=O)CCc1ccc(C)nc1Molecular Processing
Molecular formula
C13H17NO3
Molecular weight
235.28
Exact mass
235.1208
XLogP
1.7
TPSA
56.26
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
63.48
Supplementary Information
Details werden geladen…
An 3 Reaktionen beteiligt→