Molecule

ID:32107

General Information
Structure
MolImage
Molecular Formula
C₈H₇F₃
Molecular Mass
160.1363896
Exact Mass
160.04998488
Charge
0
InChI
InChI=1S/C8H7F3/c1-8(10,11)6-2-4-7(9)5-3-6/h2-5H,1H3
InChIKey
RVVCCMQGYLSSGN-UHFFFAOYSA-N
Canonic Smiles
Fc1ccc(cc1)C(F)(F)C
Isomeric Smiles
c1cc(ccc1F)C(C)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.7530985
LogD (pH = 7.4)
2.7530985
Log P
2.7530985
Molar Refractivity
36.3802
Polarizability
13.239382
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