Molecule

ID:78326

General Information
Structure
MolImage
Molecular Formula
C₄H₈I₂O
Molecular Mass
325.91466
Exact Mass
325.86646088
Charge
0
InChI
InChI=1S/C4H8I2O/c5-1-3-7-4-2-6/h1-4H2
InChIKey
XWYDQETVMJZUOJ-UHFFFAOYSA-N
Canonic Smiles
ICCOCCI
Isomeric Smiles
O(CCI)CCI
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.3732603
LogD (pH = 7.4)
2.3732603
Log P
2.3732603
Molar Refractivity
48.4715
Polarizability
19.419455
Polar Surface Area
9.23
Rotatable Bonds
4
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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