(1R)-7alpha-Ethenyl-1,2,3,4,4a,4balpha,5,6,7,8,10,10aalpha-Dodecahydro-1,4abeta,7-Trimethyl-1alpha-Phenanthrenecarboxylic Acid Methyl Ester
[CAS# 1686-62-0]

Identification

• Name: (1R)-7alpha-Ethenyl-1,2,3,4,4a,4balpha,5,6,7,8,10,10aalpha-Dodecahydro-1,4abeta,7-Trimethyl-1alpha-Phenanthrenecarboxylic Acid Methyl Ester
• Synonyms: Methyl (1R,4Ar,4Bs,7S,10Ar)-1,4A,7-Trimethyl-7-Vinyl-3,4,4B,5,6,8,10,10A-Octahydro-2H-Phenanthrene-1-Carboxylate; (1R,4Ar,4Bs,7S,10Ar)-1,4A,7-Trimethyl-7-Vinyl-3,4,4B,5,6,8,10,10A-Octahydro-2H-Phenanthrene-1-Carboxylic Acid Methyl Ester; 1-Phenanthrenecarboxylic Acid, 7-Ethenyl-1,2,3,4,4A,4B,5,6,7,8,10,10A-Dodecahydro-1,4A,7-Trimethyl-, Methyl Ester, (1R-(1Alpha,4Abeta,4Balpha,7Alpha,10Aalpha))-
• Molecular Formula: C₂₁H₃₂O₂
• Molecular Weight: 316.48
• CAS Registry Number: 1686-62-0
• SMILES: [C@]12([C@H]([C@@](C(=O)OC)(C)CCC1)CC=C3[C@@H]2CC[C@@](C=C)(C)C3)C
• InChI: 1S/C21H32O2/c1-6-19(2)13-10-16-15(14-19)8-9-17-20(16,3)11-7-12-21(17,4)18(22)23-5/h6,8,16-17H,1,7,9-14H2,2-5H3/t16-,17+,19-,20+,21+/m0/s1
• InChIKey: QMZKBAQNFAMESG-GBMAXXPESA-N

Properties

• Density: 1.016g/cm³ (Cal.)
• Boiling point: 383.689°C at 760 mmHg (Cal.)
• Flash point: 180.194°C (Cal.)