Phosphono 3,7,11,15,19,23,27,31,35,39,43-Undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-Undecaenyl Hydrogen Phosphate
[CAS# 31867-59-1]

Identification

• Name: Phosphono 3,7,11,15,19,23,27,31,35,39,43-Undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-Undecaenyl Hydrogen Phosphate
• Synonyms: Phosphono [(2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-Undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-Undecaenyl] Hydrogen Phosphate; Undecaprenyl-Diphosphate; Bactoprenyl Pyrophosphate
• Molecular Formula: C₅₅H₉₂O₇P₂
• Molecular Weight: 927.28
• CAS Registry Number: 31867-59-1
• SMILES: C(C/C=C(/CC/C=C(/CC/C=C(/CC\C=C(\CCC=C(C)C)C)C)C)C)\C(=C\CC\C(=C\CC\C(=C\CC\C(=C\CC\C(=C\CC\C(C)=C\CO[P](O[P](O)(O)=O)(O)=O)C)C)C)C)C
• InChI: 1S/C55H92O7P2/c1-45(2)23-13-24-46(3)25-14-26-47(4)27-15-28-48(5)29-16-30-49(6)31-17-32-50(7)33-18-34-51(8)35-19-36-52(9)37-20-38-53(10)39-21-40-54(11)41-22-42-55(12)43-44-61-64(59,60)62-63(56,57)58/h23,25,27,29,31,33,35,37,39,41,43H,13-22,24,26,28,30,32,34,36,38,40,42,44H2,1-12H3,(H,59,60)(H2,56,57,58)/b46-25+,47-27+,48-29+,49-31+,50-33+,51-35+,52-37+,53-39+,54-41+,55-43+
• InChIKey: NTXGVHCCXVHYCL-RDQGWRCRSA-N

Properties

• Density: 1.011g/cm³ (Cal.)
• Boiling point: 891.402°C at 760 mmHg (Cal.)
• Flash point: 492.902°C (Cal.)