Molecule

ID:129554

General Information
Structure
Molecular Formula
C₁₂H₂₇NaOSi
Molecular Mass
238.41745
Exact Mass
238.1728863
Charge
0
InChI
InChI=1S/C12H27OSi.Na/c1-10(2,3)14(13,11(4,5)6)12(7,8)9;/h1-9H3;/q-1;+1
InChIKey
QAGFKHQOLBYGIF-UHFFFAOYSA-N
Canonic Smiles
CC([Si](C(C)(C)C)(C(C)(C)C)[O-])(C)C.[Na+]
Isomeric Smiles
[Na+].CC(C)(C)[Si]([O-])(C(C)(C)C)C(C)(C)C
Calculated Properties
JChem
Acid pKa
11.733957
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
3.0266998
LogD (pH = 7.4)
3.02668
Log P
3.0267
Molar Refractivity
59.9498
Polarizability
26.101324
Polar Surface Area
23.06
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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