(1'R,2S,2'alpha,4S,5S,1R)-5,7'beta-Dibromo-4-Chloro-4,4'alpha,6',6'-Tetramethylspiro[Cyclohexane-1,5'-[3,8]Dioxatricyclo[5.1.0.0(2,4)]Octan]-2-Ol
[CAS# 55304-01-3]

Identification

• Name: (1'R,2S,2'alpha,4S,5S,1R)-5,7'beta-Dibromo-4-Chloro-4,4'alpha,6',6'-Tetramethylspiro[Cyclohexane-1,5'-[3,8]Dioxatricyclo[5.1.0.0(2,4)]Octan]-2-Ol
• Synonyms: {Spiro[Cyclohexane-1,5'-[3,} {8]Dioxatricyclo[5.1.0.02,4]} Octan]-2-Ol, 5,7'-Dibromo-4-Chloro-4, 4',6',6'-Tetramethyl-, {[1'R-[1'.Alpha.,2'.Beta.,4'.Beta.,} 5'.Alpha. (2S*,4S*,5S*), 7'.Alpha.]]-; Spiro[Cyclohexane-1,5'-[3,8]Dioxatricyclo[5.1.0.02,4] Octan]-2-Ol, 5,7'-Dibromo-4-Chloro-4,4',6',6'-Tetramethyl-, [1'R-[1'.Alpha.,2'.Beta.,4'.Beta.,5'.Alpha. (2S*,4S*,5S*), 7'.Alpha.]]-; Prepacifenol Epoxide
• Molecular Formula: C₁₅H₂₁Br₂ClO₃
• Molecular Weight: 444.59
• CAS Registry Number: 55304-01-3
• SMILES: CC24C(C1C(O1)(C(C23C(CC(C(C3)Br)(Cl)C)O)(C)C)Br)O4
• InChI: 1S/C15H21Br2ClO3/c1-11(2)14(5-7(16)12(3,18)6-8(14)19)13(4)9(20-13)10-15(11,17)21-10/h7-10,19H,5-6H2,1-4H3
• InChIKey: AHEAISCIGHPMGI-UHFFFAOYSA-N

Properties

• Density: 1.756g/cm³ (Cal.)
• Boiling point: 463.396°C at 760 mmHg (Cal.)
• Flash point: 234.054°C (Cal.)