Name: 2-propyl-4-trifluoromethylphenol
SMILES:
CCCc1cc(C(F)(F)F)ccc1OMolecular Processing
Molecular formula
C10H11F3O
Molecular weight
204.19
Exact mass
204.0762
XLogP
3.36
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
14
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
0.4
Molar refractivity
47.1
Supplementary Information
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