3-[3-(2-Hydroxy-6-Methyl-5-Hepten-2-Yl)-7-Isopropenyl-6,9A,9B-Trimethyldodecahydro-1H-Cyclopenta[a]Naphthalen-6-Yl]Propanoic Acid
[CAS# 34336-09-9]

Identification

• Name: 3-[3-(2-Hydroxy-6-Methyl-5-Hepten-2-Yl)-7-Isopropenyl-6,9A,9B-Trimethyldodecahydro-1H-Cyclopenta[a]Naphthalen-6-Yl]Propanoic Acid
• Synonyms: 3,4-Secodammara-4(28),24-dien-3-oic acid, 20-hydroxy-; 3-[3-(1-Hydroxy-1,5-dimethyl-4-hexenyl)-7-isopropenyl-6,9a,9b-trimethyldodecahydro-1H-cyclopenta[a]naphthalen-6-yl]propanoic acid; 3-[3-(1-Hydroxy-1,5-dimethyl-4-hexenyl)-7-isopropenyl-6,9a,9b-trimethyldodecahydro-1H-cyclopenta[a]naphthalen-6-yl]propanoic acid #
• Molecular Formula: C₃₀H₅₀O₃
• Molecular Weight: 458.72
• CAS Registry Number: 34336-09-9
• SMILES: O=C(O)CCC1(C(\C(=C)C)CCC3(C1CCC2C(CCC23C)C(O)(C)CC\C=C(/C)C)C)C
• InChI: 1S/C30H50O3/c1-20(2)10-9-16-30(8,33)24-14-18-28(6)23(24)11-12-25-27(5,17-15-26(31)32)22(21(3)4)13-19-29(25,28)7/h10,22-25,33H,3,9,11-19H2,1-2,4-8H3,(H,31,32)
• InChIKey: SITSHJMXTJRDSK-UHFFFAOYSA-N

Properties

• Density: 1.002g/cm³ (Cal.)
• Boiling point: 563.964°C at 760 mmHg (Cal.)
• Flash point: 308.926°C (Cal.)