Molecule

ID:80958

General Information
Structure
Molecular Formula
C₁₆H₂₆Cl₃P
Molecular Mass
355.710401
Exact Mass
354.0837705
Charge
0
InChI
InChI=1S/C16H26Cl2P.ClH/c1-4-10-19(11-5-2,12-6-3)13-14-15(17)8-7-9-16(14)18;/h7-9H,4-6,10-13H2,1-3H3;1H/q+1;/p-1
InChIKey
FTHSQXZUBPPSNN-UHFFFAOYSA-M
Canonic Smiles
CCC[P+](Cc1c(Cl)cccc1Cl)(CCC)CCC.[Cl-]
Isomeric Smiles
[P+](Cc1c(cccc1Cl)Cl)(CCC)(CCC)CCC.[Cl-]
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
5.847137
LogD (pH = 7.4)
5.847137
Log P
5.847137
Molar Refractivity
89.6332
Polarizability
35.560738
Polar Surface Area
0.0
Rotatable Bonds
8
Lipinski's Rule of Five
false
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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