(6aR,10aR)-1-Methoxy-6,6,9-Trimethyl-3-(2-Methyl-2-Octanyl)-6A,7,10,10A-Tetrahydro-6H-Benzo[c]Chromene
[CAS# 174627-50-0]

Identification

• Name: (6aR,10aR)-1-Methoxy-6,6,9-Trimethyl-3-(2-Methyl-2-Octanyl)-6A,7,10,10A-Tetrahydro-6H-Benzo[c]Chromene
• Synonyms: (6aR,10aR)-3-(1,1-Dimethyl-heptyl)-1-methoxy-6,6,9-trimethyl-6a,7,10,10a-tetrahydro-6H-benzo[c]chromene; (6aR,10aR)-3-(1,1-Dimethylheptyl)-6a,7,10,10a-tetrahydro-1-methoxy-6,6,9-trimethyl-6H-dibenzo[b,d]pyran; L-759,633
• Molecular Formula: C₂₆H₄₀O₂
• Molecular Weight: 384.59
• CAS Registry Number: 174627-50-0
• SMILES: CCCCCCC(C)(C)C1=CC2=C([C@@H]3CC(=CC[C@H]3C(O2)(C)C)C)C(=C1)OC
• InChI: 1S/C26H40O2/c1-8-9-10-11-14-25(3,4)19-16-22(27-7)24-20-15-18(2)12-13-21(20)26(5,6)28-23(24)17-19/h12,16-17,20-21H,8-11,13-15H2,1-7H3/t20-,21-/m1/s1
• InChIKey: SUFMHSFGODDLKI-NHCUHLMSSA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Boiling point: 447.9±45.0°C at 760 mmHg (Cal.)
• Flash point: 134.2±28.3°C (Cal.)
• Refractive index: 1.5 (Cal.)
• solubility: Soluble to 25 mM in DMSO and to 50 mM in ethanol