(1S,2R,4aS)-1-(3-Hydroxypropanoyl)-1,3,6,8-Tetramethyl-1,2,4A,5,6,7,8,8A-Octahydro-2-Naphthalenecarboxylic Acid
[CAS# 41060-01-9]

Identification

• Name: (1S,2R,4aS)-1-(3-Hydroxypropanoyl)-1,3,6,8-Tetramethyl-1,2,4A,5,6,7,8,8A-Octahydro-2-Naphthalenecarboxylic Acid
• Molecular Formula: C₁₈H₂₈O₄
• Molecular Weight: 308.41
• CAS Registry Number: 41060-01-9
• SMILES: O=C(O)[C@@H]1/C(=C\[C@@H]2CC(CC(C2[C@@]1(C(=O)CCO)C)C)C)C
• InChI: 1S/C18H28O4/c1-10-7-11(2)15-13(8-10)9-12(3)16(17(21)22)18(15,4)14(20)5-6-19/h9-11,13,15-16,19H,5-8H2,1-4H3,(H,21,22)/t10?,11?,13-,15?,16-,18-/m0/s1
• InChIKey: SFTQDPVLDKOILY-CSVHMLKNSA-N

Properties

• Density: 1.08g/cm³ (Cal.)
• Boiling point: 464.392°C at 760 mmHg (Cal.)
• Flash point: 248.774°C (Cal.)