Molecule

ID:7542

General Information
Structure
MolImage
Molecular Formula
C₁₀H₂₁O₅P
Molecular Mass
252.244501
Exact Mass
252.1126604
Charge
0
InChI
InChI=1S/C10H21O5P/c1-4-13-10(11)8-7-9-16(12,14-5-2)15-6-3/h4-9H2,1-3H3
InChIKey
FYESTJSRASJZOY-UHFFFAOYSA-N
Canonic Smiles
CCOC(=O)CCCP(=O)(OCC)OCC
Isomeric Smiles
O=C(OCC)CCCP(=O)(OCC)OCC
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
1.0387793
LogD (pH = 7.4)
1.0387793
Log P
1.0387793
Molar Refractivity
60.8203
Polarizability
24.684145
Polar Surface Area
61.83
Rotatable Bonds
10
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
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References
Bioactivity
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