Molecule

ID:80778

General Information
Structure
MolImage
Molecular Formula
C₁₄H₁₀Cl₂O
Molecular Mass
265.1346
Exact Mass
264.0108703
Charge
0
InChI
InChI=1S/C14H10Cl2O/c15-11-7-3-1-5-9(11)13-14(17-13)10-6-2-4-8-12(10)16/h1-8,13-14H
InChIKey
CYHHHQOGWYZTGK-UHFFFAOYSA-N
Canonic Smiles
Clc1ccccc1C1OC1c1ccccc1Cl
Isomeric Smiles
O1C(C1c1c(cccc1)Cl)c1c(cccc1)Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
4.729594
LogD (pH = 7.4)
4.729594
Log P
4.729594
Molar Refractivity
69.2187
Polarizability
27.296227
Polar Surface Area
12.53
Rotatable Bonds
2
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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