名称: 2-chloro-3-(2',4'-difluoro-4-biphenylyl)-2-butenoic acid ethyl ester
SMILES:
CCOC(=O)C(Cl)=C(C)c1ccc(-c2ccc(F)cc2F)cc1Molecular Processing
Molecular formula
C18H15ClF2O2
Molecular weight
336.77
Exact mass
336.0729
XLogP
5.16
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
86.87
Supplementary Information
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