Molecule
ID:11992
General Information
Molecular Formula
C₅F₉I
Molecular Mass
357.9435988
Exact Mass
357.89010198
Charge
0
InChI
InChI=1S/C5F9I/c6-1(2(7)15)3(8,4(9,10)11)5(12,13)14/b2-1-
InChIKey
KVLZYXPNBHIUMY-UPHRSURJSA-N
Canonic Smiles
F/C(=C(\C(C(F)(F)F)(C(F)(F)F)F)/F)/I
Isomeric Smiles
C(C(/C(=C(/I)\F)/F)(C(F)(F)F)F)(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.9735582
LogD (pH = 7.4)
3.9735582
Log P
3.9735582
Molar Refractivity
48.2386
Polarizability
15.306142
Polar Surface Area
0.0
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Loading...
Names and Identifiers
Loading...
Registration numbers
Loading...
Properties
Loading...
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Loading...
Bioactivity
Loading...