Molecule

ID:74983

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₅O₃P
Molecular Mass
214.198061
Exact Mass
214.07588097
Charge
0
InChI
InChI=1S/C10H15O3P/c1-9-4-6-10(7-5-9)8-14(11,12-2)13-3/h4-7H,8H2,1-3H3
InChIKey
GLCMITCQPZPVDU-UHFFFAOYSA-N
Canonic Smiles
COP(=O)(Cc1ccc(cc1)C)OC
Isomeric Smiles
P(=O)(OC)(OC)Cc1ccc(cc1)C
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.1399314
LogD (pH = 7.4)
2.1399314
Log P
2.1399314
Molar Refractivity
55.9202
Polarizability
22.290579
Polar Surface Area
35.53
Rotatable Bonds
4
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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