2-Hydroxy-4-methoxy-6-methyl-Benzoic acid 3-formyl-2,2a,4a,5,6,7,7a,7b-octahydro-4a-hydroxy-6,6,7b-trimethyl-1H-cyclobut(e)inden-2-yl ester
[CAS# 129741-56-6]

Identification

• Name: 2-Hydroxy-4-methoxy-6-methyl-Benzoic acid 3-formyl-2,2a,4a,5,6,7,7a,7b-octahydro-4a-hydroxy-6,6,7b-trimethyl-1H-cyclobut(e)inden-2-yl ester
• Molecular Formula: C₂₄H₃₀O₆
• Molecular Weight: 414.50
• CAS Registry Number: 129741-56-6
• SMILES: [C@]13([C@@H]4[C@](O)(C=C([C@@H]1[C@H](OC(=O)C2=C(C=C(OC)C=C2O)C)C3)C=O)CC(C4)(C)C)C
• InChI: 1S/C24H30O6/c1-13-6-15(29-5)7-16(26)19(13)21(27)30-17-9-23(4)18-10-22(2,3)12-24(18,28)8-14(11-25)20(17)23/h6-8,11,17-18,20,26,28H,9-10,12H2,1-5H3/t17-,18-,20-,23-,24+/m1/s1
• InChIKey: BGKXQRPQNIXIMH-MEVKZITKSA-N

Properties

• Density: 1.282g/cm³ (Cal.)
• Boiling point: 558.104°C at 760 mmHg (Cal.)
• Flash point: 187.637°C (Cal.)