2-(4-Isobutylcyclohexyl)-2-Oxoethyl Benzenesulfonate
[CAS# 84856-18-8]

Identification

• Name: 2-(4-Isobutylcyclohexyl)-2-Oxoethyl Benzenesulfonate
• Synonyms: [2-(4-Isobutylcyclohexyl)-2-Oxo-Ethyl] Benzenesulfonate; Benzenesulfonic Acid [2-(4-Isobutylcyclohexyl)-2-Oxoethyl] Ester; Benzenesulfonic Acid [2-(4-Isobutylcyclohexyl)-2-Keto-Ethyl] Ester
• Molecular Formula: C₁₈H₂₆O₄S
• Molecular Weight: 338.46
• CAS Registry Number: 84856-18-8
• SMILES: C2=C([S](OCC(=O)C1CCC(CC1)CC(C)C)(=O)=O)C=CC=C2
• InChI: 1S/C18H26O4S/c1-14(2)12-15-8-10-16(11-9-15)18(19)13-22-23(20,21)17-6-4-3-5-7-17/h3-7,14-16H,8-13H2,1-2H3
• InChIKey: RLVLLBHWAQWLKL-UHFFFAOYSA-N

Properties

• Density: 1.124g/cm³ (Cal.)
• Boiling point: 460.062°C at 760 mmHg (Cal.)
• Flash point: 232.038°C (Cal.)