Molecule

ID:3075

General Information
Structure
Molecular Formula
C₁₄H₃₀O₈
Molecular Mass
326.3832
Exact Mass
326.19406792
Charge
0
InChI
InChI=1S/C14H30O8/c15-1-3-17-5-7-19-9-11-21-13-14-22-12-10-20-8-6-18-4-2-16/h15-16H,1-14H2
InChIKey
XPJRQAIZZQMSCM-UHFFFAOYSA-N
Canonic Smiles
OCCOCCOCCOCCOCCOCCOCCO
Isomeric Smiles
OCCOCCOCCOCCOCCOCCOCCO
Calculated Properties
JChem
LogD (pH = 7.4)
-1.49
LogD (pH = 5.5)
-1.49
Log P
-1.49
Rotatable Bonds
19
H Donor
2
H Acceptors
8
Lipinski's Rule of Five
true
Acid pKa
14.82
Polar Surface Area
95.84
Polarizability
37.93
Molar Refractivity
80.81
LOG S
0.69
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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Related Proteins
Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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