Molecule

ID:113527

General Information
Structure
MolImage
Molecular Formula
C₄H₇ClO₂S
Molecular Mass
154.61518
Exact Mass
153.98552814
Charge
0
InChI
InChI=1S/C4H7ClO2S/c5-4-1-2-8(6,7)3-4/h4H,1-3H2
InChIKey
SEZJAAIKYHZWCH-UHFFFAOYSA-N
Canonic Smiles
ClC1CCS(=O)(=O)C1
Isomeric Smiles
S1(=O)(=O)CC(CC1)Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
-0.3839016
LogD (pH = 7.4)
-0.3839016
Log P
-0.3839016
Molar Refractivity
31.8633
Polarizability
13.509378
Polar Surface Area
34.14
Rotatable Bonds
0
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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