2-Chloro-5-Nitrotoluene-4-Sulphonic Acid
[CAS# 6973-13-3]

Identification

• Name: 2-Chloro-5-Nitrotoluene-4-Sulphonic Acid
• Synonyms: 5-Chloro-4-Methyl-2-Nitro-Benzenesulfonic Acid; 2-Chloro-5-Nitro-1-Toluene-4-Sulfonic Acid; 2-Chloro-5-Nitrotoluene-4-Sulphonic Acid
• Molecular Formula: C₇H₆ClNO₅S
• Molecular Weight: 251.64
• CAS Registry Number: 6973-13-3
• EINECS: 230-216-2
• SMILES: C1=C([S](=O)(=O)O)C(=CC(=C1Cl)C)[N+]([O-])=O
• InChI: 1S/C7H6ClNO5S/c1-4-2-6(9(10)11)7(3-5(4)8)15(12,13)14/h2-3H,1H3,(H,12,13,14)
• InChIKey: JTZLIGVBEAGAFZ-UHFFFAOYSA-N

Properties

• Density: 1.653g/cm³ (Cal.)