5-Amino-1,3,3-Trimethylcyclohexanemethylamine Toluene-p-Sulphonate
[CAS# 68133-56-2]

Identification

• Name: 5-Amino-1,3,3-Trimethylcyclohexanemethylamine Toluene-p-Sulphonate
• Synonyms: 3-(Aminomethyl)-3,5,5-Trimethyl-Cyclohexan-1-Amine; 4-Methylbenzenesulfonic Acid; 3-(Aminomethyl)-3,5,5-Trimethyl-1-Cyclohexanamine; 4-Methylbenzenesulfonic Acid; [3-(Aminomethyl)-3,5,5-Trimethyl-Cyclohexyl]Amine; 4-Methylbenzenesulfonic Acid
• Molecular Formula: C₁₇H₃₀N₂O₃S
• Molecular Weight: 342.50
• CAS Registry Number: 68133-56-2
• EINECS: 268-688-7
• SMILES: C1=C([S](=O)(=O)O)C=CC(=C1)C.C(N)C2(CC(CC(N)C2)(C)C)C
• InChI: 1S/C10H22N2.C7H8O3S/c1-9(2)4-8(12)5-10(3,6-9)7-11;1-6-2-4-7(5-3-6)11(8,9)10/h8H,4-7,11-12H2,1-3H3;2-5H,1H3,(H,8,9,10)
• InChIKey: ZBVBXDSQFYHMPD-UHFFFAOYSA-N

Properties

• Boiling point: 217.2°C at 760 mmHg (Cal.)
• Flash point: 98.7°C (Cal.)