Molecule

ID:92005

General Information
Structure
MolImage
Molecular Formula
C₈H₁₇I
Molecular Mass
240.12505
Exact Mass
240.03749854
Charge
0
InChI
InChI=1S/C8H17I/c1-2-3-4-5-6-7-8-9/h2-8H2,1H3
InChIKey
UWLHSHAHTBJTBA-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCI
Isomeric Smiles
ICCCCCCCC
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.5539613
LogD (pH = 7.4)
4.5539613
Log P
4.5539613
Molar Refractivity
51.8221
Polarizability
20.366808
Polar Surface Area
0.0
Rotatable Bonds
6
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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