Molecule

ID:82993

General Information
Structure
MolImage
Molecular Formula
C₁₈H₁₂Cl₃P
Molecular Mass
365.620641
Exact Mass
363.97422005
Charge
0
InChI
InChI=1S/C18H12Cl3P/c19-13-1-7-16(8-2-13)22(17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18/h1-12H
InChIKey
IQKSLJOIKWOGIZ-UHFFFAOYSA-N
Canonic Smiles
Clc1ccc(cc1)P(c1ccc(cc1)Cl)c1ccc(cc1)Cl
Isomeric Smiles
P(c1ccc(cc1)Cl)(c1ccc(cc1)Cl)c1ccc(cc1)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
6.6606
LogD (pH = 7.4)
6.6606
Log P
6.6606
Molar Refractivity
96.0373
Polarizability
37.80137
Polar Surface Area
0.0
Rotatable Bonds
3
Lipinski's Rule of Five
false
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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