Chem Paratoluene Sulfonic Acid - Chemical Supply - Chemryt Informatics Pvt. Ltd.

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Paratoluene Sulfonic Acid


  • SKU Code: CH136865
  • Supplier: Jigs Chemical-INDIA
Chemical Name - Paratoluene Sulfonic Acid
Mol Weight - 172.204
Smiles - Cc(cc1)ccc1S(O)(=O)=O
Property Name Property Value
Mol NameParatoluene Sulfonic Acid
Molweight172.204
Monoisotopic Mass172.019415
Clogp-0.2258
Clogs-0.566
H Acceptors3
H Donors1
Total Surface Area120.45
Relative Psa0.34604
Polar Surface Area62.75
Druglikeness-11.132
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.63636
Molecular Flexibility0.47198
Molecular Complexity0.64378
Fragments1
Non H Atoms11
Non Ch Atoms4
Electronegative Atoms4
Rotatable Bonds1
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms3
Symmetric Atoms3
Acidic Oxygens1
SmilesCc(cc1)ccc1S(O)(=O)=O
InChIC7H8O3S

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