5-Sulfo-1,3-Benzenedicarboxylic Acid, Monosodium Salt, Compound With 1,6-Hexanediamine (1:1)
[CAS# 51178-75-7]

Identification

• Name: 5-Sulfo-1,3-Benzenedicarboxylic Acid, Monosodium Salt, Compound With 1,6-Hexanediamine (1:1)
• Synonyms: Sodium; 3-Carboxy-5-Sulfo-Benzoate; Hexane-1,6-Diamine; Sodium; 6-Aminohexylamine; 3-Carboxy-5-Sulfo-Benzoate
• Molecular Formula: C₁₄H₂₁N₂NaO₇S
• Molecular Weight: 384.38
• CAS Registry Number: 51178-75-7
• SMILES: C1=C(C=C(C=C1[S](=O)(=O)O)C(=O)O)C([O-])=O.C(CCCN)CCN.[Na+]
• InChI: 1S/C8H6O7S.C6H16N2.Na/c9-7(10)4-1-5(8(11)12)3-6(2-4)16(13,14)15;7-5-3-1-2-4-6-8;/h1-3H,(H,9,10)(H,11,12)(H,13,14,15);1-8H2;/q;;+1/p-1
• InChIKey: URULHBSSDRCVQG-UHFFFAOYSA-M