Molecule

ID:9746

General Information
Structure
MolImage
Molecular Formula
C₃H₇ClO₂S
Molecular Mass
142.60448
Exact Mass
141.98552814
Charge
0
InChI
InChI=1S/C3H7ClO2S/c1-3(2)7(4,5)6/h3H,1-2H3
InChIKey
DRINJBFRTLBHNF-UHFFFAOYSA-N
Canonic Smiles
CC(S(=O)(=O)Cl)C
Isomeric Smiles
C(S(=O)(=O)Cl)(C)C
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
0.8827841
LogD (pH = 7.4)
0.8827841
Log P
0.8827841
Molar Refractivity
29.5182
Polarizability
12.453823
Polar Surface Area
34.14
Rotatable Bonds
1
Lipinski's Rule of Five
true
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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