Name: ethyl 5-chloro-6-(1,1-difluoroethyl)nicotinate
SMILES:
CCOC(=O)c1cnc(C(C)(F)F)c(Cl)c1Molecular Processing
Molecular formula
C10H10ClF2NO2
Molecular weight
249.64
Exact mass
249.0368
XLogP
3.02
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
54.77
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→