الاسم: (E)-4-cyclopentyl-2-(3,4-difluoro-phenyl)-but-2-enoic acid methyl ester
SMILES:
COC(=O)/C(=C/CC1CCCC1)c1ccc(F)c(F)c1Molecular Processing
Molecular formula
C16H18F2O2
Molecular weight
280.31
Exact mass
280.1275
XLogP
4.1
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
72.93
Supplementary Information
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