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Chemistry | Software | Chem 4 Nitrobenzene Sulphonyl Chloride

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4-Nitrobenzene sulphonyl chloride


  • SKU Code: CH136471
Chemical Name - 4-Nitrobenzene sulphonyl chloride
Mol Weight - 123.111
Smiles - [O-][N+](c1ccccc1)=O.O=S(Cl)(Cl)=O
Property Name Property Value
Mol Name4-Nitrobenzene sulphonyl chloride
Molweight123.111
Monoisotopic Mass123.032029
Clogp0.738
Clogs-2.076
H Acceptors3
Total Surface Area96.93
Relative Psa0.31383
Polar Surface Area45.82
Druglikeness-7.6783
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritanthigh
Shape Index0.66667
Molecular Flexibility0.36206
Molecular Complexity0.62123
Fragments1
Non H Atoms9
Non Ch Atoms3
Electronegative Atoms3
Rotatable Bonds1
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms1
Symmetric Atoms2
Acidic Oxygens1
Smiles[O-][N+](c1ccccc1)=O.O=S(Cl)(Cl)=O

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