Molecule

ID:32073

General Information
Structure
MolImage
Molecular Formula
C₇H₅F₃
Molecular Mass
146.1098096
Exact Mass
146.03433482
Charge
0
InChI
InChI=1S/C7H5F3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,7H
InChIKey
DBXNELKUWAMRKY-UHFFFAOYSA-N
Canonic Smiles
FC(c1ccccc1F)F
Isomeric Smiles
c1(c(cccc1)C(F)F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.5050356
LogD (pH = 7.4)
2.5050356
Log P
2.5050356
Molar Refractivity
31.3584
Polarizability
11.446779
Polar Surface Area
0.0
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
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
Bioactivity
Navigation