Molecule

ID:74979

General Information
Structure
MolImage
Molecular Formula
C₇H₁₅O₅P
Molecular Mass
210.164761
Exact Mass
210.06571021
Charge
0
InChI
InChI=1S/C7H15O5P/c1-10-7(8)5-4-6-13(9,11-2)12-3/h4-6H2,1-3H3
InChIKey
JJHDDMXTDDIZAS-UHFFFAOYSA-N
Canonic Smiles
COC(=O)CCCP(=O)(OC)OC
Isomeric Smiles
P(=O)(OC)(OC)CCCC(=O)OC
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
-0.010573004
LogD (pH = 7.4)
-0.010573004
Log P
-0.010573004
Molar Refractivity
46.5745
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
No Data Available
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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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