ISOAMYL HEXANOATE
Product Description
Product Detail
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Product Name: |
ISOAMYL HEXANOATE |
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Synonyms: |
Hexanoic acid, 3-methylbutyl ester;Hexanoic acid, isopentyl ester;Hexanoicacid,3-methylbutylester;hexanoicacid,isopentylester;isopentyl caproate;3-METHYLBUTYL HEXANOATE;ISOAMYL HEXANOATE;ISOAMYL N-HEXANOATE |
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CAS: |
2198-61-0 |
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MF: |
C11H22O2 |
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MW: |
186.29 |
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EINECS: |
218-600-8 |
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Product Categories: |
Alphabetical Listings;Certified Natural ProductsFlavors and Fragrances;Flavors and Fragrances;I-L |
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Mol File: |
2198-61-0.mol |
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Melting point |
-47°C (estimate) |
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Boiling point |
222 °C(lit.) |
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density |
0.86 g/mL at 25 °C(lit.) |
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FEMA |
2075 | ISOAMYL HEXANOATE |
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refractive index |
n20/D 1.42(lit.) |
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Fp |
185 °F |
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storage temp. |
Store below +30°C. |
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JECFA Number |
46 |
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CAS DataBase Reference |
2198-61-0(CAS DataBase Reference) |
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NIST Chemistry Reference |
Isopentyl hexanoate(2198-61-0) |
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EPA Substance Registry System |
Hexanoic acid, 3-methylbutyl ester (2198-61-0) |
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Safety Statements |
24/25 |
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WGK Germany |
2 |
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RTECS |
MO8389300 |
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HS Code |
29159080 |
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HS Code |
29349990 |
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Toxicity |
LD50 orally in Rabbit: > 5000 mg/kg LD50 dermal Rabbit > 5000 mg/kg |
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Description |
Isoamyl hexanoate has a fruity odor. May be prepared by esterification of caproic acid with the isomeric amyl alcohols obtained from fusel oil and other sources. |
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Chemical Properties |
Isoamyl hexanoate has an apple, pineapple, fruity, green, sweet odor. |
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Chemical Properties |
Colorless liquid |
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Uses |
Isoamyl Hexanoate is a synthetic flavoring agent that is a stable, colorless liquid of fruity odor. It is soluble in alcohol, fixed oils, and mineral oil. Storage should be in glass, tin, or resin-lined containers. It is used in fruit flavors such as banana and pineapple for applications in desserts, candy, and ice cream at 4–22 ppm. |
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Preparation |
By esterification of caproic acid with the isomeric amyl alcohols obtained from fusel oil and other sources. |
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Definition |
ChEBI: A fatty acid ester obtained by the formal condensation of the carboxy group of hexanoic acid (caproic acid) with the alcoholic hydroxy group of 3-methylbutan-1-ol (isoamylol). |
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Taste threshold values |
Taste characteristics at 25 ppm: fruity, green, pineapple with a waxy nuance |
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Raw materials |
Hexanoic acid |