Nom: 3-(2',4'-difluoro-4-biphenylyl)-2-butenoic acid ethyl ester
SMILES:
CCOC(=O)C=C(C)c1ccc(-c2ccc(F)cc2F)cc1Molecular Processing
Molecular formula
C18H16F2O2
Molecular weight
302.32
Exact mass
302.1118
XLogP
4.6
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
82.08
Supplementary Information
Récupération des détails…
Impliqué dans 5 réactions→