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Chem 1 Hexane Sulphonic Acid Sodium Salt | Cheminformatics

1-Hexane Sulphonic Acid Sodium Salt


  • SKU Code: CH137285
Chemical Name - 1-Hexane Sulphonic Acid Sodium Salt
Mol Weight - 165.232
Smiles - CCCCCCS([O-])(=O)=O.[Na+]
Property Name Property Value
Mol Name1-Hexane Sulphonic Acid Sodium Salt
Molweight165.232
Monoisotopic Mass165.05854
Clogp-0.7531
Clogs-1.288
H Acceptors3
Total Surface Area130.67
Relative Psa0.328
Polar Surface Area65.58
Druglikeness-26.401
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.8
Molecular Flexibility0.61974
Molecular Complexity0.57565
Fragments2
Non H Atoms10
Non Ch Atoms4
Electronegative Atoms4
Rotatable Bonds5
Sp3 Atoms8
Symmetric Atoms1
Acidic Oxygens1
SmilesCCCCCCS([O-])(=O)=O.[Na+]
InChIKeyInChI=1S/C6H14O3S.Na/c1-2-3-4-5-6-10(7,8)9;/h2-6H2,1H3,(H,7,8,9);/q;+1/p-1
InChIQWSZRRAAFHGKCH-UHFFFAOYSA-M

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