Molecule
ID:93825
General Information
Molecular Formula
C₄H₄F₃I
Molecular Mass
235.9742396
Exact Mass
235.93098279
Charge
0
InChI
InChI=1S/C4H4F3I/c1-3(8)2-4(5,6)7/h2H,1H3
InChIKey
FUJZKLJZJYRSNP-UHFFFAOYSA-N
Canonic Smiles
C/C(=C\C(F)(F)F)/I
Isomeric Smiles
I/C(=C/C(F)(F)F)/C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.5723078
LogD (pH = 7.4)
2.5723078
Log P
2.5723078
Molar Refractivity
35.7602
Polarizability
12.9372
Polar Surface Area
0.0
Rotatable Bonds
1
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...