cis-3-Hexenyl isobutyrate
ALDRICH/W392901 - ≥98%, stabilized, FG
Synonym: (Z)-3-hexen-1-yl isobutyrate
CAS Number: 41519-23-7
Empirical Formula (Hill Notation): C10H18O2
Molecular Weight: 170.25
EC Number: 255-424-0
MDL Number: MFCD00036529
Linear Formula: (CH3)2CHCO2CH2CH=CHCH2CH2CH3
Product Type: Chemical
| agency | follows IFRA guidelines |
| meets purity specifications of JECFA | |
| application(s) | flavors and fragrances |
| assay | ≥98% |
| biological source | synthetic |
| bp | 92 °C/20 mmHg (lit.) |
| contains | 0.01-0.20% α-tocopherol, synthetic as stabilizer |
| density | 0.878 g/mL at 25 °C (lit.) |
| documentation | see Safety & Documentation for available documents |
| food allergen | no known allergens |
| fragrance allergen | no known allergens |
| grade | FG |
| Fragrance grade | |
| Halal | |
| Kosher | |
| InChI | 1S/C10H18O2/c1-4-5-6-7-8- |
| InChI key | OSMAJVWUIUORGC-WAYWQWQTSA |
| organoleptic | apple; green; fruity |
| Quality Level | 300  |
| 400 |
|
| refractive index | n |
| reg. compliance | EU Regulation 1223/2009 |
| EU Regulation 1334/2008 & 178/2002 | |
| SMILES string | [H]C(CC)=C(/[H])CCOC(=O) |
| Biochem/physiol Actions: | Odor at 1% |
| Biochem/physiol Actions: | Taste at 1-5 ppm |
| General description: | Natural occurrence: Guava, spearmint, Chinese quince. |
| Packaging: | 1 kg in glass bottle |
| Packaging: | 100 g in glass bottle |
| Symbol |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315 |
| Hazard Codes | Xi |
| Risk Statements | 38 |
| Safety Statements | 36 |
| WGK Germany | WGK 2 |
| Flash Point(F) | 185.0 °F - closed cup |
| Flash Point(C) | 85 °C - closed cup |
| Purity | ≥98% |
| bp | 92 °C/20 mmHg (lit.) |
| Density | 0.878 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| FEMA Number | 3929 |
| UNSPSC | 12164502 |