Molecule

ID:75013

General Information
Structure
MolImage
Molecular Formula
C₁₁H₂₁O₅P
Molecular Mass
264.255201
Exact Mass
264.1126604
Charge
0
InChI
InChI=1S/C11H21O5P/c1-5-14-11(12)8-10(4)9-17(13,15-6-2)16-7-3/h8H,5-7,9H2,1-4H3
InChIKey
OQKGPUSERILONW-UHFFFAOYSA-N
Canonic Smiles
CCOC(=O)/C=C(/CP(=O)(OCC)OCC)\C
Isomeric Smiles
P(=O)(OCC)(OCC)C/C(=C/C(=O)OCC)/C
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
1.9310948
LogD (pH = 7.4)
1.9310948
Log P
1.9310948
Molar Refractivity
66.0416
Polarizability
26.25924
Polar Surface Area
61.83
Rotatable Bonds
9
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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