(Z)-Octadec-9-Enyl [5-[[[2-[[(Perfluorooctyl)Sulphonyl]Methylamino]Ethoxy]Carbonyl]Amino]-o-Tolyl]Carbamate
[CAS# 94313-84-5]

Identification

• Name: (Z)-Octadec-9-Enyl [5-[[[2-[[(Perfluorooctyl)Sulphonyl]Methylamino]Ethoxy]Carbonyl]Amino]-o-Tolyl]Carbamate
• Synonyms: [(E)-Octadec-9-Enyl] N-[5-[2-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Heptadecafluorooctylsulfonylmethylamino)Ethoxycarbonylamino]-2-Methylphenyl]Carbamate; [(E)-Octadec-9-Enyl] N-[5-[2-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Heptadecafluorooctylsulfonylmethylamino)E
• Molecular Formula: C₃₈H₅₀F₁₇N₃O₆S
• Molecular Weight: 999.86
• CAS Registry Number: 94313-84-5
• EINECS: 304-984-5
• SMILES: C1=C(NC(OCCNC[S](=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=O)C=CC(=C1NC(OCCCCCCCC\C=C\CCCCCCCC)=O)C
• InChI: 1S/C38H50F17N3O6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-63-30(60)58-28-24-27(20-19-26(28)2)57-29(59)64-23-21-56-25-65(61,62)38(54,55)36(49,50)34(45,46)32(41,42)31(39,40)33(43,44)35(47,48)37(51,52)53/h10-11,19-20,24,56H,3-9,12-18,21-23,25H2,1-2H3,
• InChIKey: KYCJOIBTYDJNPD-ZHACJKMWSA-N

Properties

• Density: 1.339g/cm³ (Cal.)
• Boiling point: 695.019°C at 760 mmHg (Cal.)
• Flash point: 374.134°C (Cal.)