4-(Toluene-4-Sulfonylamino)-Cyclohexanecarboxylic Acid
[CAS# 314042-69-8]

Identification

• Name: 4-(Toluene-4-Sulfonylamino)-Cyclohexanecarboxylic Acid
• Synonyms: 4-[(4-Methylphenyl)Sulfonylamino]-1-Cyclohexanecarboxylate; Zinc00053201
• Molecular Formula: C₁₄H₁₈NO₄S
• Molecular Weight: 296.36
• CAS Registry Number: 314042-69-8
• SMILES: C2=C([S](=O)(=O)NC1CCC(CC1)C([O-])=O)C=CC(=C2)C
• InChI: 1S/C14H19NO4S/c1-10-2-8-13(9-3-10)20(18,19)15-12-6-4-11(5-7-12)14(16)17/h2-3,8-9,11-12,15H,4-7H2,1H3,(H,16,17)/p-1
• InChIKey: PKHCQZVVYAPDCE-UHFFFAOYSA-M

Properties

• Boiling point: 491.163°C at 760 mmHg (Cal.)
• Flash point: 250.846°C (Cal.)