Molecule

ID:129988

General Information
Structure
MolImage
Molecular Formula
C₆H₁₅Al
Molecular Mass
114.164838
Exact Mass
114.09891411
Charge
0
InChI
InChI=1S/3C2H5.Al/c3*1-2;/h3*1H2,2H3;
InChIKey
VOITXYVAKOUIBA-UHFFFAOYSA-N
Canonic Smiles
CC[Al](CC)CC
Isomeric Smiles
CC[Al](CC)CC
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.884
LogD (pH = 7.4)
2.884
Log P
2.884
Molar Refractivity
31.0407
Polarizability
14.303335
Polar Surface Area
0.0
Rotatable Bonds
3
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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