Molecule

ID:7863

General Information
Structure
MolImage
Molecular Formula
C₃Cl₃F₃O
Molecular Mass
215.3857096
Exact Mass
213.89668232
Charge
0
InChI
InChI=1S/C3Cl3F3O/c4-2(5,6)1(10)3(7,8)9
InChIKey
AVTAIKNWAIKGEV-UHFFFAOYSA-N
Canonic Smiles
O=C(C(Cl)(Cl)Cl)C(F)(F)F
Isomeric Smiles
O=C(C(F)(F)F)C(Cl)(Cl)Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.9909968
LogD (pH = 7.4)
2.9909968
Log P
2.9909968
Molar Refractivity
32.7196
Polarizability
12.186627
Polar Surface Area
17.07
Rotatable Bonds
2
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
References
Bioactivity
Navigation