Molecule

ID:90206

General Information
Structure
MolImage
Molecular Formula
C₇H₁₅O₅P
Molecular Mass
210.164761
Exact Mass
210.06571021
Charge
0
InChI
InChI=1S/C7H15O5P/c1-4-11-13(9,12-5-2)6-7(8)10-3/h4-6H2,1-3H3
InChIKey
CTSAXXHOGZNKJR-UHFFFAOYSA-N
Canonic Smiles
CCOP(=O)(CC(=O)OC)OCC
Isomeric Smiles
P(=O)(CC(=O)OC)(OCC)OCC
Calculated Properties
JChem
Acid pKa
18.009193
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
0.2768087
LogD (pH = 7.4)
0.2768087
Log P
0.2768087
Molar Refractivity
46.8649
Polarizability
19.229486
Polar Surface Area
61.83
Rotatable Bonds
7
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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