2,5-Dichloro-3-Nitrotoluene-4-Sulphonic Acid
[CAS# 68368-41-2]

Identification

• Name: 2,5-Dichloro-3-Nitrotoluene-4-Sulphonic Acid
• Synonyms: 3,6-Dichloro-4-Methyl-2-Nitro-Benzenesulfonic Acid; 2,5-Dichloro-3-Nitrotoluene-4-Sulphonic Acid; Benzenesulfonic Acid, 3,6-Dichloro-4-Methyl-2-Nitro-
• Molecular Formula: C₇H₅Cl₂NO₅S
• Molecular Weight: 286.09
• CAS Registry Number: 68368-41-2
• EINECS: 269-873-5
• SMILES: C1=C(C(=C(C(=C1Cl)[S](=O)(=O)O)[N+]([O-])=O)Cl)C
• InChI: 1S/C7H5Cl2NO5S/c1-3-2-4(8)7(16(13,14)15)6(5(3)9)10(11)12/h2H,1H3,(H,13,14,15)
• InChIKey: UDOKNLFADJCCNE-UHFFFAOYSA-N

Properties

• Density: 1.742g/cm³ (Cal.)