[2-[(alpha-O-Tolylbenzyl)Oxy]Ethyl]Dimethylammonium Hexadecyl Sulphate
[CAS# 94249-00-0]

Identification

• Name: [2-[(alpha-O-Tolylbenzyl)Oxy]Ethyl]Dimethylammonium Hexadecyl Sulphate
• Synonyms: Dimethyl-[2-(O-Tolyl-Phenyl-Methoxy)Ethyl]Ammonium; Hexadecyl Sulfate; Dimethyl-[2-(O-Tolyl-Phenylmethoxy)Ethyl]Ammonium; Hexadecyl Sulfate; Cetyl Sulfate; Dimethyl-[2-(O-Tolyl-Phenyl-Methoxy)Ethyl]Ammonium
• Molecular Formula: C₃₄H₅₇NO₅S
• Molecular Weight: 591.89
• CAS Registry Number: 94249-00-0
• EINECS: 304-377-5
• SMILES: C(O[S]([O-])(=O)=O)CCCCCCCCCCCCCCC.C1=CC=CC(=C1C(OCC[NH+](C)C)C2=CC=CC=C2)C
• InChI: 1S/C18H23NO.C16H34O4S/c1-15-9-7-8-12-17(15)18(20-14-13-19(2)3)16-10-5-4-6-11-16;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-21(17,18)19/h4-12,18H,13-14H2,1-3H3;2-16H2,1H3,(H,17,18,19)
• InChIKey: YHELGDAPVZOPJE-UHFFFAOYSA-N

Properties

• Boiling point: 666.2°C at 760 mmHg (Cal.)
• Flash point: 356.7°C (Cal.)