7-[[(1R)-1,4,4abeta,5,6,7,8,8alpha-Octahydro-6alpha-Hydroxy-2,5,5,8aalpha-Tetramethylnaphthalen-1-Yl]Methoxy]-2H-1-Benzopyran-2-One
[CAS# 51020-36-1]

Identification

• Name: 7-[[(1R)-1,4,4abeta,5,6,7,8,8alpha-Octahydro-6alpha-Hydroxy-2,5,5,8aalpha-Tetramethylnaphthalen-1-Yl]Methoxy]-2H-1-Benzopyran-2-One
• Synonyms: 7-[[(1R,4As,6R,8Ar)-6-Hydroxy-2,5,5,8A-Tetramethyl-1,4,4A,6,7,8-Hexahydronaphthalen-1-Yl]Methoxy]-2-Chromenone; 7-[[(1R,4As,6R,8Ar)-6-Hydroxy-2,5,5,8A-Tetramethyl-1,4,4A,6,7,8-Hexahydronaphthalen-1-Yl]Methoxy]Coumarin; Stock1n-23902
• Molecular Formula: C₂₄H₃₀O₄
• Molecular Weight: 382.50
• CAS Registry Number: 51020-36-1
• SMILES: [C@@]12([C@@H](C(C)(C)[C@@H](CC1)O)CC=C([C@H]2COC4=CC3=C(C=CC(O3)=O)C=C4)C)C
• InChI: 1S/C24H30O4/c1-15-5-9-20-23(2,3)21(25)11-12-24(20,4)18(15)14-27-17-8-6-16-7-10-22(26)28-19(16)13-17/h5-8,10,13,18,20-21,25H,9,11-12,14H2,1-4H3/t18-,20-,21-,24+/m1/s1
• InChIKey: MCTDXPDDZLFJHR-XLRKYUMYSA-N

Properties

• Density: 1.135g/cm³ (Cal.)
• Boiling point: 530.669°C at 760 mmHg (Cal.)
• Flash point: 178.936°C (Cal.)