589-59-3
isobutyl isovalerate
CAS: 589-59-3
Molecular Formula: C9H18O2
589-59-3 - Names and Identifiers
| Name | isobutyl isovalerate |
| Synonyms | Isobutylisovalerat isobutyl isovalerate IsoBUTYL-isoVALERATEFCC Isobutyl 3-methylpropanoate ISOBUTYL ISOVALERATE, NATURAL 2-Methyl-1-propyl isovalerate Isovaleric acid isobutyl ester 2-methylpropyl 3-methylbutanoate Butanoicacid,3-methyl-,2-methylpropylester Butanoic acid, 3-methyl-, 2-methylpropyl ester |
| CAS | 589-59-3 |
| EINECS | 209-653-8 |
| InChI | InChI=1/C9H18O2/c1-7(2)5-9(10)11-6-8(3)4/h7-8H,5-6H2,1-4H3 |
589-59-3 - Physico-chemical Properties
| Molecular Formula | C9H18O2 |
| Molar Mass | 158.24 |
| Density | 0.853g/mLat 20°C(lit.) |
| Melting Point | -92.8°C (estimate) |
| Boling Point | 168 °C |
| Flash Point | 57 °C |
| JECFA Number | 203 |
| Vapor Presure | 1.43mmHg at 25°C |
| Appearance | clear liquid |
| Color | Colorless to Almost colorless |
| Merck | 14,5146 |
| Storage Condition | Sealed in dry,Room Temperature |
| Refractive Index | n20/D 1.406 |
589-59-3 - Risk and Safety
| Hazard Symbols | Xi - Irritant |
| Risk Codes | 36/37/38 - Irritating to eyes, respiratory system and skin. |
| Safety Description | 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. |
| UN IDs | UN 1993C 3 / PGIII |
| WGK Germany | 2 |
| RTECS | NY1506000 |
| HS Code | 29156000 |
| Hazard Class | 3 |
| Packing Group | III |
589-59-3 - Reference Information
| FEMA | 3369 | 2-METHYLPROPYL 3-METHYLBUTYRATE |
| olfactory threshold (Odor Threshold) | 0.0052ppm |
| NIST chemical information | Information provided by: webbook.nist.gov (external link) |
| EPA chemical information | Information provided by: ofmpub.epa.gov (external link) |
| toxicity | GRAS(FEMA). |
| usage limit | FEMA(mg/kg): non-alcoholic beverages, cold drinks, gel foods, puddings, smeared foods, all 5.0; Candy and baked goods 8.0. |
Last Update：2024-04-09 21:11:58
