Molecule

ID:32118

General Information
Structure
MolImage
Molecular Formula
C₉H₇F₅
Molecular Mass
210.143896
Exact Mass
210.04679132
Charge
0
InChI
InChI=1S/C9H7F5/c1-8(10,11)6-4-2-3-5-7(6)9(12,13)14/h2-5H,1H3
InChIKey
BDNFFEDUKSTDLI-UHFFFAOYSA-N
Canonic Smiles
CC(c1ccccc1C(F)(F)F)(F)F
Isomeric Smiles
c1c(c(ccc1)C(F)(F)F)C(C)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.488245
LogD (pH = 7.4)
3.488245
Log P
3.488245
Molar Refractivity
42.1375
Polarizability
14.913622
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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