6-Chloro-3-Nitrotoluene-2-Sulphonic Acid
[CAS# 68368-39-8]

Identification

• Name: 6-Chloro-3-Nitrotoluene-2-Sulphonic Acid
• Synonyms: 3-Chloro-2-Methyl-6-Nitro-Benzenesulfonic Acid; Benzenesulfonic Acid, 3-Chloro-2-Methyl-6-Nitro-
• Molecular Formula: C₇H₆ClNO₅S
• Molecular Weight: 251.64
• CAS Registry Number: 68368-39-8
• EINECS: 269-870-9
• SMILES: C1=CC(=C(C(=C1Cl)C)[S](=O)(=O)O)[N+]([O-])=O
• InChI: 1S/C7H6ClNO5S/c1-4-5(8)2-3-6(9(10)11)7(4)15(12,13)14/h2-3H,1H3,(H,12,13,14)
• InChIKey: IRDVVOKGYRSNHH-UHFFFAOYSA-N

Properties

• Density: 1.653g/cm³ (Cal.)