Name: (5-chloro-4′-fluoro-2′-formyl-biphenyl-3-yl)-acetic acid ethyl ester
SMILES:
CCOC(=O)Cc1cc(Cl)cc(-c2ccc(F)cc2C=O)c1Molecular Processing
Molecular formula
C17H14ClFO3
Molecular weight
320.75
Exact mass
320.0616
XLogP
4.06
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
22
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
0.176
Molar refractivity
82.57
Supplementary Information
Details werden geladen…
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