Molecule

ID:7720

General Information
Structure
MolImage
Molecular Formula
C₁₀H₃F₁₇
Molecular Mass
446.1036744
Exact Mass
445.99632984
Charge
0
InChI
InChI=1S/C10H3F17/c1-2-3(11,12)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)10(25,26)27/h2H,1H2
InChIKey
NKAMGQZDVMQEJL-UHFFFAOYSA-N
Canonic Smiles
C=CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Isomeric Smiles
C(C(C(C(C(C(C(C(C=C)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
6.76237
LogD (pH = 7.4)
6.76237
Log P
6.76237
Molar Refractivity
49.2578
Polarizability
18.95324
Polar Surface Area
0.0
Rotatable Bonds
8
Lipinski's Rule of Five
false
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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