Molecule

ID:98510

General Information
Structure
MolImage
Molecular Formula
C₃BrF₅
Molecular Mass
210.928116
Exact Mass
209.9103531
Charge
0
InChI
InChI=1S/C3BrF5/c4-3(8,9)1(5)2(6)7
InChIKey
SPZXNEBFTNEDGH-UHFFFAOYSA-N
Canonic Smiles
FC(=C(C(Br)(F)F)F)F
Isomeric Smiles
FC(C(=C(F)F)F)(Br)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.1695006
LogD (pH = 7.4)
2.1695006
Log P
2.1695006
Molar Refractivity
35.4825
Polarizability
9.201347
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
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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