Molecule

ID:97410

General Information
Structure
MolImage
Molecular Formula
C₃F₄O₂
Molecular Mass
144.0245128
Exact Mass
143.98344212
Charge
0
InChI
InChI=1S/C3F4O2/c4-2(9)1(8)3(5,6)7
InChIKey
NSODUNDFRPXDAR-UHFFFAOYSA-N
Canonic Smiles
FC(=O)C(=O)C(F)(F)F
Isomeric Smiles
FC(=O)C(=O)C(F)(F)F
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
1.443943
LogD (pH = 7.4)
1.443943
Log P
1.443943
Molar Refractivity
18.2234
Polarizability
6.653307
Polar Surface Area
34.14
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