Molecule

ID:438

General Information
Structure
MolImage
Molecular Formula
C₃F₈
Molecular Mass
188.0193256
Exact Mass
187.98722576
Charge
0
InChI
InChI=1S/C3F8/c4-1(5,2(6,7)8)3(9,10)11
InChIKey
QYSGYZVSCZSLHT-UHFFFAOYSA-N
Canonic Smiles
FC(C(F)(F)F)(C(F)(F)F)F
Isomeric Smiles
FC(F)(C(F)(F)F)C(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.78236
LogD (pH = 7.4)
2.78236
Log P
2.78236
Molar Refractivity
17.5372
Polarizability
6.707999
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
ALOGPS 2.1
Log P
2.96
LOG S
-3.11
Solubility (Water)
1.46e-01 g/l
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
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References
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Bioactivity
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