Molecule

ID:9863

General Information
Structure
Molecular Formula
C₃H₅FO₂
Molecular Mass
92.0690032
Exact Mass
92.02735762
Charge
0
InChI
InChI=1S/C3H5FO2/c1-6-3(5)2-4/h2H2,1H3
InChIKey
RJBYSQHLLIHSLT-UHFFFAOYSA-N
Canonic Smiles
COC(=O)CF
Isomeric Smiles
O=C(CF)OC
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
-0.0036079304
LogD (pH = 7.4)
-0.0036079304
Log P
-0.0036079304
Molar Refractivity
17.4229
Polarizability
6.9597683
Polar Surface Area
26.3
Rotatable Bonds
2
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
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Molecule Details
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References
Bioactivity
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