(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-Nonamethyl-2,6,10,14,18,22,26,30,34-Hexatriacontanonaen-1-Yl Trihydrogen Diphosphate
[CAS# 146340-00-3]

Identification

• Name: (2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-Nonamethyl-2,6,10,14,18,22,26,30,34-Hexatriacontanonaen-1-Yl Trihydrogen Diphosphate
• Synonyms: (2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-yl trihydrogen diphosphate; all-trans-Nonaprenyl diphosphate
• Molecular Formula: C₄₅H₇₆O₇P₂
• Molecular Weight: 791.03
• CAS Registry Number: 146340-00-3
• SMILES: O=P(O)(O)OP(=O)(O)OC/C=C(/CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)C)C
• InChI: 1S/C45H76O7P2/c1-37(2)19-11-20-38(3)21-12-22-39(4)23-13-24-40(5)25-14-26-41(6)27-15-28-42(7)29-16-30-43(8)31-17-32-44(9)33-18-34-45(10)35-36-51-54(49,50)52-53(46,47)48/h19,21,23,25,27,29,31,33,35H,11-18,20,22,24,26,28,30,32,34,36H2,1-10H3,(H,49,50)(H2,46,47,48)/b38-21+,39-23+,40-25+,41-27+,42-29+,43-31+,44-33+,45-35+
• InChIKey: IVLBHBFTRNVIAP-MEGGAXOGSA-N

Properties

• Density: 1.033g/cm³ (Cal.)
• Boiling point: 811.789°C at 760 mmHg (Cal.)
• Flash point: 444.754°C (Cal.)
• Refractive index: 1.517 (Cal.)