(4aR,8aR)-3,3,6,7-Tetramethyl-3,4,4a,7,8,8a-hexahydro-1H-isochromene
[CAS# 93904-61-1]

Identification

• Name: (4aR,8aR)-3,3,6,7-Tetramethyl-3,4,4a,7,8,8a-hexahydro-1H-isochromene
• Synonyms: (4aα,7α,8aβ)-3,4,4a,7,8,8a-hexahydro-3,3,6,7-tetramethyl-1H-2-benzopyran; (4aα,7β,8aβ)-3,4,4a,7,8,8a-hexahydro-3,3,6,7-tetramethyl-1H-2-benzopyran
• Molecular Formula: C₁₃H₂₂O
• Molecular Weight: 194.31
• CAS Registry Number: 93904-61-1
• EINECS: 299-800-2
• SMILES: CC1(C)C[C@@H]2C=C(C)C(C)C[C@H]2CO1
• InChI: 1S/C13H22O/c1-9-5-11-7-13(3,4)14-8-12(11)6-10(9)2/h5,10-12H,6-8H2,1-4H3/t10?,11-,12-/m0/s1
• InChIKey: HIHXXYCXFIAFGQ-RAMGSTBQSA-N

Properties

• Density: 0.887g/cm³ (Cal.)
• Boiling point: 248.902°C at 760 mmHg (Cal.)
• Flash point: 100.545°C (Cal.)