Molecule

ID:16021

General Information
Structure
MolImage
Molecular Formula
C₁₀H₇I
Molecular Mass
254.06705
Exact Mass
253.95924822
Charge
0
InChI
InChI=1S/C10H7I/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H
InChIKey
FRNLBIWVMVNNAZ-UHFFFAOYSA-N
Canonic Smiles
Ic1ccc2c(c1)cccc2
Isomeric Smiles
c1ccc2c(c1)cc(cc2)I
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.8916671
LogD (pH = 7.4)
3.8916671
Log P
3.8916671
Molar Refractivity
55.8707
Polarizability
22.760042
Polar Surface Area
0.0
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
References
Bioactivity
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