| Melting point |
27.0 to 31.0 °C |
| Boiling point |
312.9±27.0 °C(Predicted) |
| Density |
1.12 g/mL at 25 °C (lit.) |
| vapor pressure |
0.017Pa at 20℃ |
| FEMA |
3754 | VANILLIN ISOBUTYRATE |
| refractive index |
n20/D 1.524(lit.) |
| Flash point |
>230 °F |
| storage temp. |
2-8°C, stored under nitrogen |
| solubility |
soluble in Methanol |
| form |
powder to crystal |
| color |
White to Almost white |
| Odor |
at 100.00 %. sweet vanilla creamy fruity caramel chocolate |
| Odor Type |
vanilla |
| biological source |
synthetic |
| Water Solubility |
573mg/L at 20℃ |
| λmax |
311nm(1-Butanol)(lit.) |
| JECFA Number |
891 |
| Major Application |
flavors and fragrances |
| Cosmetics Ingredients Functions |
PERFUMING |
| InChI |
1S/C12H14O4/c1-8(2)12(14)16-10-5-4-9(7-13)6-11(10)15-3/h4-8H,1-3H3 |
| InChIKey |
BGKAKRUFBSTALK-UHFFFAOYSA-N |
| SMILES |
COc1cc(C=O)ccc1OC(=O)C(C)C |
| LogP |
2 |
| CAS DataBase Reference |
20665-85-4(CAS DataBase Reference) |
| EPA Substance Registry System |
Vanillin isobutyrate (20665-85-4) |
