(Ethylbenzyl)Dimethyloctadecylammonium Chloride
[CAS# 29661-60-7]

Identification

• Name: (Ethylbenzyl)Dimethyloctadecylammonium Chloride
• Synonyms: [1,1-Dimethyl-2-(1-Phenylpropyl)Octadecyl]Ammonium Chloride; (Ethylbenzyl)Dimethyloctadecylammonium Chloride
• Molecular Formula: C₂₉H₅₄ClN
• Molecular Weight: 452.21
• CAS Registry Number: 29661-60-7
• EINECS: 249-760-7
• SMILES: C1=C(C(C(C([NH3+])(C)C)CCCCCCCCCCCCCCCC)CC)C=CC=C1.[Cl-]
• InChI: 1S/C29H53N.ClH/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28(29(3,4)30)27(6-2)26-23-20-19-21-24-26;/h19-21,23-24,27-28H,5-18,22,25,30H2,1-4H3;1H
• InChIKey: XRPYPOUYRVKIQQ-UHFFFAOYSA-N

Properties

• Boiling point: 501.8°C at 760 mmHg (Cal.)
• Flash point: 200.2°C (Cal.)