Molecule

ID:105435

General Information
Structure
MolImage
Molecular Formula
C₁₀H₂₀Fe
Molecular Mass
196.1108
Exact Mass
196.09143814
Charge
0
InChI
InChI=1S/2C5H10.Fe/c2*1-2-4-5-3-1;/h2*1-5H2;
InChIKey
KPCCMGYPEIQAEN-UHFFFAOYSA-N
Canonic Smiles
C1CCCC1.C1CCCC1.[Fe]
Isomeric Smiles
[Fe].C1CCCC1.C1CCCC1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.2228434
LogD (pH = 7.4)
2.2228434
Log P
2.2228434
Molar Refractivity
23.005
Polarizability
9.23521
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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