Cetylmannoside
[CAS# 96790-89-5]

Identification

• Name: Cetylmannoside
• Synonyms: (3S,4S,5S,6R)-2-Hexadecoxy-6-(Hydroxymethyl)Tetrahydropyran-3,4,5-Triol; (3S,4S,5S,6R)-2-Cetyloxy-6-Methylol-Tetrahydropyran-3,4,5-Triol; Cetylmannoside
• Molecular Formula: C₂₂H₄₄O₆
• Molecular Weight: 404.59
• CAS Registry Number: 96790-89-5
• SMILES: [C@@H]1([C@H]([C@@H]([C@H](OC1OCCCCCCCCCCCCCCCC)CO)O)O)O
• InChI: 1S/C22H44O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-27-22-21(26)20(25)19(24)18(17-23)28-22/h18-26H,2-17H2,1H3/t18-,19-,20+,21+,22?/m1/s1
• InChIKey: PAEMERHSTIDLSE-RPKDUVEISA-N

Properties

• Density: 1.077g/cm³ (Cal.)
• Boiling point: 543.62°C at 760 mmHg (Cal.)
• Flash point: 282.571°C (Cal.)