3-Amino-6-Nitrotoluene-4-Sulphonic Acid
[CAS# 41521-55-5]

Identification

• Name: 3-Amino-6-Nitrotoluene-4-Sulphonic Acid
• Synonyms: 2-Amino-4-Methyl-5-Nitro-Benzenesulfonic Acid; 3-Amino-6-Nitrotoluene-4-Sulphonic Acid
• Molecular Formula: C₇H₈N₂O₅S
• Molecular Weight: 232.21
• CAS Registry Number: 41521-55-5
• EINECS: 255-425-6
• SMILES: C1=C([N+]([O-])=O)C(=CC(=C1[S](=O)(=O)O)N)C
• InChI: 1S/C7H8N2O5S/c1-4-2-5(8)7(15(12,13)14)3-6(4)9(10)11/h2-3H,8H2,1H3,(H,12,13,14)
• InChIKey: FGHYCAHVTIVKDB-UHFFFAOYSA-N

Properties

• Density: 1.628g/cm³ (Cal.)