7,10-Bis[O-(triethylsilyl)]-10-deacetyl Baccatin III
[CAS# 149107-84-6]

Identification

• Name: 7,10-Bis[O-(triethylsilyl)]-10-deacetyl Baccatin III
• Synonyms: 7,10-Bis[O-(triethylsilyl)]-10-deacetyl Baccatin III
• Molecular Formula: C₄₁H₆₄O₁₀Si₂
• Molecular Weight: 773.11
• CAS Registry Number: 149107-84-6
• SMILES: O=C3[C@]5([C@H]([C@H](OC(=O)c1ccccc1)[C@@]2(O)C(C(=C(\C)[C@@H](O)C2)\[C@H]3O[Si](CC)(CC)CC)(C)C)[C@@]4(OC(=O)C)[C@H](OC4)C[C@@H]5O[Si](CC)(CC)CC)C
• InChI: 1S/C41H64O10Si2/c1-12-52(13-2,14-3)50-30-23-31-40(25-47-31,49-27(8)42)34-36(48-37(45)28-21-19-18-20-22-28)41(46)24-29(43)26(7)32(38(41,9)10)33(35(44)39(30,34)11)51-53(15-4,16-5)17-6/h18-22,29-31,33-34,36,43,46H,12-17,23-25H2,1-11H3/t29-,30-,31+,33+,34-,36-,39+,40-,41+/m0/s1
• InChIKey: ZTAIYJPKYUNPKQ-RHJDUELYSA-N

Properties

• Density: 1.161g/cm³ (Cal.)
• Boiling point: 736.662°C at 760 mmHg (Cal.)
• Flash point: 399.319°C (Cal.)
• Refractive index: 1.542 (Cal.)