COCCCc1nc(C(F)(F)F)ccc1C=CC(=O)O
SMILES: COCCCc1nc(C(F)(F)F)ccc1C=CC(=O)O

Molecular Processing

Molecular formula
C13H14F3NO3
Molecular weight
289.25
Exact mass
289.0926
XLogP
2.78
TPSA
59.42
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
66.11

Supplementary Information

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