Molecule

ID:7972

General Information
Structure
MolImage
Molecular Formula
C₈H₇F₃
Molecular Mass
160.1363896
Exact Mass
160.04998488
Charge
0
InChI
InChI=1S/C8H7F3/c1-6-3-2-4-7(5-6)8(9,10)11/h2-5H,1H3
InChIKey
VJYXZJGDFJJDGF-UHFFFAOYSA-N
Canonic Smiles
Cc1cccc(c1)C(F)(F)F
Isomeric Smiles
c1cc(cc(c1)C(F)(F)F)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.3645158
LogD (pH = 7.4)
3.3645158
Log P
3.3645158
Molar Refractivity
37.0729
Polarizability
13.205154
Polar Surface Area
0.0
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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