(-)-3-Chloro-4,6-Dihydroxy-2-Methyl-5-[(2E,6E)-3-Methyl-7-[(2S,4S)-Tetrahydro-4-Hydroxy-5,5-Dimethylfuran-2-Yl]-2,6-Octadienyl]Benzaldehyde
[CAS# 51759-79-6]

Identification

• Name: (-)-3-Chloro-4,6-Dihydroxy-2-Methyl-5-[(2E,6E)-3-Methyl-7-[(2S,4S)-Tetrahydro-4-Hydroxy-5,5-Dimethylfuran-2-Yl]-2,6-Octadienyl]Benzaldehyde
• Synonyms: 5-Chloro-2,4-Dihydroxy-3-[(2E,6E)-7-[(2S,4S)-4-Hydroxy-5,5-Dimethyl-Tetrahydrofuran-2-Yl]-3-Methyl-Octa-2,6-Dienyl]-6-Methyl-Benzaldehyde; 5-Chloro-2,4-Dihydroxy-3-[(2E,6E)-7-[(2S,4S)-4-Hydroxy-5,5-Dimethyl-2-Tetrahydrofuranyl]-3-Methylocta-2,6-Dienyl]-6-Methylbenzaldehyde; 5-Chloro-2,4-Dihydroxy-3-[(2E,6E)-7-[(2S,4S)-4-Hydroxy-5,5-Dimethyl-Oxolan-2-Yl]-3-Methyl-Octa-2,6-Dienyl]-6-Methyl-Benzaldehyde
• Molecular Formula: C₂₃H₃₁ClO₅
• Molecular Weight: 422.95
• CAS Registry Number: 51759-79-6
• SMILES: [C@@H]1(O)C(O[C@@H](C1)\C(=C\CC/C(=C/CC2=C(O)C(=C(C(=C2O)C=O)C)Cl)C)C)(C)C
• InChI: 1S/C23H31ClO5/c1-13(7-6-8-14(2)18-11-19(26)23(4,5)29-18)9-10-16-21(27)17(12-25)15(3)20(24)22(16)28/h8-9,12,18-19,26-28H,6-7,10-11H2,1-5H3/b13-9+,14-8+/t18-,19-/m0/s1
• InChIKey: YHXSUSPTGLHIRR-UZFWGDPLSA-N

Properties

• Density: 1.211g/cm³ (Cal.)
• Boiling point: 588.913°C at 760 mmHg (Cal.)
• Flash point: 309.963°C (Cal.)