Hexyl butyrate
Synonym(s):Butyric acid hexyl ester, Hexyl butanoate;Hexyl butanoate;Hexyl butyrate
- CAS NO.:2639-63-6
- Empirical Formula: C10H20O2
- Molecular Weight: 172.26
- MDL number: MFCD00048884
- EINECS: 220-136-6
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-12-18 14:15:30
What is Hexyl butyrate?
Description
Hexyl butyrate has a characteristic fruity (apricot) odor and a sweet taste suggestive of pineapple. May be synthesized from butyric acid and n-hexyl alcohol in the presence of HCL.
Chemical properties
Hexyl Butyrate is a liquid with a powerful fruity odor. It has been identified in a number of fruits and berries and is an important constituent of fruit flavor compositions.
Chemical properties
Hexyl butyrate has a characteristic fruity (apricot) odor and sweet taste suggestive of pineapple.
Occurrence
Reported found in the essential oils of lavender and lavandin and in the oil from fruits of Heracleum giganteum. Also reported found in apple, apricot, banana, citrus peel oils, cranberry, guava, grapes, strawberry fruit and jam, thymus, Gruyere cheese, beer, cognac, rum, cider, tea, passion fruit, plum, plumcot, starfruit, mango, mountain papaya, Chinese quince peel and hog plum (Spondias mombins L.)
Definition
ChEBI: A fatty acid ester obtained by the formal condensation of hexanol with butyric acid.
Preparation
From butyric acid and n-hexyl alcohol in the presence of HCl
Aroma threshold values
Detection: 250 ppb
Taste threshold values
Taste characteristics at 10 ppm: fruity, green, waxy, fatty and vegetative.
Flammability and Explosibility
Not classified
Properties of Hexyl butyrate
Melting point: | -78°C |
Boiling point: | 205 °C(lit.) |
Density | 0.851 g/mL at 25 °C(lit.) |
vapor pressure | 30Pa at 20℃ |
FEMA | 2568 | HEXYL BUTYRATE |
refractive index | n |
Flash point: | 178 °F |
storage temp. | Store below +30°C. |
form | neat |
color | Colorless to Almost colorless |
Odor | at 10.00 % in dipropylene glycol. green sweet fruity apple waxy soapy |
Water Solubility | 20.3mg/L at 20℃ |
JECFA Number | 153 |
CAS DataBase Reference | 2639-63-6(CAS DataBase Reference) |
NIST Chemistry Reference | Butanoic acid, hexyl ester(2639-63-6) |
EPA Substance Registry System | Butanoic acid, hexyl ester (2639-63-6) |
Safety information for Hexyl butyrate
Signal word | Warning |
Pictogram(s) |
Exclamation Mark Irritant GHS07 |
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 Hexyl butyrate
Hexyl butyrate manufacturer
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