Basic information Safety Related Supplier
(3aR)-4,4a,7aα,8,9,9aα-Hexahydro-4α-(isobutyryloxy)-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2,5(3H,3aαH)-dione Structure

(3aR)-4,4a,7aα,8,9,9aα-Hexahydro-4α-(isobutyryloxy)-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2,5(3H,3aαH)-dione

Chemical Properties

Boiling point 472.5±45.0 °C(Predicted)
Density  1.16±0.1 g/cm3(Predicted)
storage temp.  2-8°C
solubility  water: slightly soluble
form  Solid
color  White to off-white
biological source plant
Water Solubility  water: slightly soluble
Major Application metabolomics
vitamins, nutraceuticals, and natural products
InChI 1S/C19H26O5/c1-9(2)17(21)24-16-15-11(4)18(22)23-13(15)8-10(3)12-6-7-14(20)19(12,16)5/h6-7,9-13,15-16H,8H2,1-5H3/t10-,11+,12+,13-,15-,16+,19+/m1/s1
InChIKey WKUOPGZYLRFCHJ-APDQSUQKSA-N
SMILES O1[C@H]2[C@H]([C@@H]([C@]3([C@H]([C@@H](C2)C)C=CC3=O)C)OC(=O)C(C)C)[C@@H](C1=O)C

Safety Information

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Skin Sens. 1

Usage And Synthesis

(3aR)-4,4a,7aα,8,9,9aα-Hexahydro-4α-(isobutyryloxy)-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2,5(3H,3aαH)-dione Supplier

(3aR)-4,4a,7aα,8,9,9aα-Hexahydro-4α-(isobutyryloxy)-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2,5(3H,3aαH)-dione manufacturers