Isoamyl hexanoate, mixture of isomers
ALDRICH/W207500 - FCC
Synonym: Isoamyl caproate
CAS Number: 2198-61-0
Empirical Formula (Hill Notation): C11H22O2
Molecular Weight: 186.29
Linear Formula: C11H22O2
Product Type: Chemical
| agency | meets purity specifications of JECFA |
| application(s) | flavors and fragrances |
| assay | 98% |
| biological source | synthetic |
| bp | 222 °C (lit.) |
| density | 0.86 g/mL at 25 °C (lit.) |
| documentation | see Safety & Documentation for available documents |
| food allergen | no known allergens |
| grade | Halal |
| Kosher | |
| InChI | 1S/C11H22O2/c1-4-5-6-7-11 |
| InChI key | XVSZRAWFCDHCBP-UHFFFAOYSA |
| organoleptic | apple; green; fruity; pineapple; sweet |
| Quality Level | 300  |
| 400 |
|
| refractive index | n |
| reg. compliance | FCC |
| FDA 21 CFR 117 | |
| FDA 21 CFR 172.515 | |
| SMILES string | CCCCCC(=O)OCCC(C)C |
| Disclaimer: | For R&D or non-EU Food use. Not for retail sale. |
| Packaging: | 1 kg in glass bottle |
| Packaging: | 9 kg in poly drum |
| WGK Germany | WGK 2 |
| Flash Point(F) | 185.0 °F - closed cup |
| Flash Point(C) | 85 °C - closed cup |
| Purity | 98% |
| bp | 222 °C (lit.) |
| Density | 0.86 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| FEMA Number | 2075 |
| UNSPSC | 12164502 |