Molecule

ID:10657

General Information
Structure
MolImage
Molecular Formula
C₅H₁₀Cl₂O₂
Molecular Mass
173.0377
Exact Mass
172.00578492
Charge
0
InChI
InChI=1S/C5H10Cl2O2/c6-1-3-8-5-9-4-2-7/h1-5H2
InChIKey
NLXGURFLBLRZRO-UHFFFAOYSA-N
Canonic Smiles
ClCCOCOCCCl
Isomeric Smiles
C(OCOCCCl)CCl
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
1.5166546
LogD (pH = 7.4)
1.5166546
Log P
1.5166546
Molar Refractivity
37.552097
Polarizability
15.132194
Polar Surface Area
18.46
Rotatable Bonds
6
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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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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