trans-3-Hexenoic acid
Synonym(s):(E)-3-Hexenoic acid
- CAS NO.：1577-18-0
- Empirical Formula: C6H10O2
- Molecular Weight: 114.14
- MDL number: MFCD00002786
- EINECS: 216-417-8
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-12-18 14:08:57
What is trans-3-Hexenoic acid?
Chemical properties
clear colorless to pale yellow liquid
The Uses of trans-3-Hexenoic acid
trans-3-Hexenoic acid was used in the preparation of trans-3-hexen-1-ol, starting reagent for the synthesis of endo-brevicomin.
Definition
ChEBI: A 3-hexenoic acid having the trans configuration.
General Description
trans-3-Hexenoic acid occurs naturally in strawberry and bamboo leaves volatile oil.
Properties of trans-3-Hexenoic acid
| Melting point: | 11-12 °C (lit.) |
| Boiling point: | 118-119 °C/22 mmHg (lit.) |
| Density | 0.963 g/mL at 25 °C (lit.) |
| vapor density | >1 (vs air) |
| refractive index | n |
| FEMA | 3170 | 3-HEXENOIC ACID |
| Flash point: | >230 °F |
| storage temp. | Sealed in dry,Room Temperature |
| form | clear liquid |
| pka | pK1:4.72 (25°C) |
| color | Colorless to Light yellow to Light orange |
| Odor | at 1.00 % in dipropylene glycol. powerful fruity honey acid |
| Water Solubility | SLIGHTLY SOLUBLE |
| JECFA Number | 317 |
| BRN | 1700862 |
| CAS DataBase Reference | 1577-18-0(CAS DataBase Reference) |
| NIST Chemistry Reference | 3-Hexenoic acid, (E)-(1577-18-0) |
| EPA Substance Registry System | 3-Hexenoic acid, (3E)- (1577-18-0) |
Safety information for trans-3-Hexenoic acid
| Signal word | Danger |
| Pictogram(s) |
 Corrosion Corrosives GHS05 |
| GHS Hazard Statements |
H314:Skin corrosion/irritation |
| Precautionary Statement Codes |
P280:Wear protective gloves/protective clothing/eye protection/face protection. P363:Wash contaminated clothing before reuse. P301+P330+P331:IF SWALLOWED: Rinse mouth. Do NOT induce vomiting. P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for trans-3-Hexenoic acid
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