(S)-3,4,11,11a-Tetrahydro-10-Hydroxy-4,4,11a-Trimethyl-8-(1-Methylethyl)-Benzo(5,6)Cyclohepta(1,2-b)Pyran-2,9-Dione
[CAS# 72711-84-3]

Identification

• Name: (S)-3,4,11,11a-Tetrahydro-10-Hydroxy-4,4,11a-Trimethyl-8-(1-Methylethyl)-Benzo(5,6)Cyclohepta(1,2-b)Pyran-2,9-Dione
• Synonyms: Bharangin
• Molecular Formula: C₂₀H₂₄O₄
• Molecular Weight: 328.41
• CAS Registry Number: 72711-84-3
• SMILES: [C@@]23(CC1=C(C(C(=CC1=CC=C2C(C)(C)CC(O3)=O)C(C)C)=O)O)C
• InChI: 1S/C20H24O4/c1-11(2)13-8-12-6-7-15-19(3,4)10-16(21)24-20(15,5)9-14(12)18(23)17(13)22/h6-8,11,23H,9-10H2,1-5H3/t20-/m0/s1
• InChIKey: HMJSIJZITOCLAD-FQEVSTJZSA-N

Properties

• Density: 1.205g/cm³ (Cal.)
• Boiling point: 588.306°C at 760 mmHg (Cal.)
• Flash point: 212.094°C (Cal.)