Molecule

ID:136838

General Information
Structure
MolImage
Molecular Formula
C₄H₉ClMg
Molecular Mass
116.87226
Exact Mass
116.02431967
Charge
0
InChI
InChI=1S/C4H9.ClH.Mg/c1-4(2)3;;/h4H,1H2,2-3H3;1H;/q;;+1/p-1
InChIKey
YUPZOKFCNKSJTR-UHFFFAOYSA-M
Canonic Smiles
Cl[Mg]CC(C)C
Isomeric Smiles
CC(C)C[Mg]Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
1.4943
LogD (pH = 7.4)
1.4943
Log P
1.4943
Molar Refractivity
25.6328
Polarizability
11.93631
Polar Surface Area
0.0
Rotatable Bonds
2
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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