Molecule

ID:7020

General Information
Structure
MolImage
Molecular Formula
C₄H₄Br₂ClF₃
Molecular Mass
304.3307696
Exact Mass
301.83203647
Charge
0
InChI
InChI=1S/C4H4Br2ClF3/c5-2-1-3(7,8)4(6,9)10/h1-2H2
InChIKey
RJOGGYLEOPNVJV-UHFFFAOYSA-N
Canonic Smiles
BrCCC(C(Br)(F)F)(Cl)F
Isomeric Smiles
C(Br)CC(C(F)(F)Br)(F)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.7380388
LogD (pH = 7.4)
3.7380388
Log P
3.7380388
Molar Refractivity
41.4275
Polarizability
16.087872
Polar Surface Area
0.0
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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