الاسم: methyl 7-(4-fluorophenyl)-7-oxoheptanoate
SMILES:
COC(=O)CCCCCC(=O)c1ccc(F)cc1Molecular Processing
Molecular formula
C14H17FO3
Molecular weight
252.28
Exact mass
252.1162
XLogP
3.13
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
65.83
Supplementary Information
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