Molecule

ID:63352

General Information
Structure
MolImage
Molecular Formula
C₄H₇IO
Molecular Mass
198.00225
Exact Mass
197.95416284
Charge
0
InChI
InChI=1S/C4H7IO/c5-4-1-2-6-3-4/h4H,1-3H2
InChIKey
BKIQORJIKOPRCG-UHFFFAOYSA-N
Canonic Smiles
IC1COCC1
Isomeric Smiles
C1COCC1I
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
1.1712824
LogD (pH = 7.4)
1.1712824
Log P
1.1712824
Molar Refractivity
33.2808
Polarizability
13.297631
Polar Surface Area
9.23
Rotatable Bonds
0
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
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References
Bioactivity
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