TRANS-2-HEXENYL ISOVALERATE
Synonym(s):2-Hexenyl 3-methylbutanoate
- CAS NO.：68698-59-9
- Empirical Formula: C11H20O2
- Molecular Weight: 184.28
- MDL number: MFCD00036544
- EINECS: 272-088-0
- SAFETY DATA SHEET (SDS)
- Update Date: 2026-05-24 22:25:33
What is TRANS-2-HEXENYL ISOVALERATE?
Chemical properties
(E)-2-Hexenyl isovalerate has a fruity, buttery odor.
Occurrence
Reported found in lamb’s lettuce
Definition
ChEBI: 2-hexenyl isovalerate is a fatty ester resulting from the formal condensation of the carboxy group of isovaleric acid with the hydroxy group of 2-hexen-1-ol. It has a role as a volatile oil component. It is functionally related to an isovaleric acid and a 2-hexen-1-ol.
Aroma threshold values
Aroma characteristics at 1.0%: green, fresh waxy apple, pear and banana-like with nuances of viney fusel grape and vegetables.
Taste threshold values
Taste characteristics at 1 to 5 ppm: green apple, fruity with an oily waxy nuance and a lingering fruity aftertaste.
Properties of TRANS-2-HEXENYL ISOVALERATE
| Boiling point: | 231.5±9.0 °C(Predicted) |
| Density | 0.87 |
| refractive index | 1.4300-1.4340 |
| FEMA | 3930 | TRANS-2-HEXENYL ISOVALERATE |
| Odor | at 10.00 % in dipropylene glycol. green waxy apple pear banana grape |
| JECFA Number | 1377 |
| EPA Substance Registry System | (E)-2-Hexenyl isovalerate (68698-59-9) |
Safety information for TRANS-2-HEXENYL ISOVALERATE
| Signal word | Warning |
| GHS Hazard Statements |
H227:Flammable liquids |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P280:Wear protective gloves/protective clothing/eye protection/face protection. P370+P378:In case of fire: Use … for extinction. P403+P235:Store in a well-ventilated place. Keep cool. P501:Dispose of contents/container to..… |
Computed Descriptors for TRANS-2-HEXENYL ISOVALERATE
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