Allyl heptanoate
- CAS No.
- 142-19-8
- Chemical Name:
- Allyl heptanoate
- Synonyms
- ALLYL HEPTOATE;ALLYL HEPTYLATE;FEMA 2031;Allyl Oenanthate;2-PROPENYL HEPTANOATE;ALLYLHEPTAT;Allylheptanoat;ALLYL ENANTHATE;Allyl-n-heptoate;ALLYL HEPTANOATE
- CBNumber:
- CB2366829
- Molecular Formula:
- C10H18O2
- Molecular Weight:
- 170.25
- MOL File:
- 142-19-8.mol
- MSDS File:
- SDS
- Modify Date:
- 2024/6/5 16:01:44
| Melting point | -66 °C |
|---|---|
| Boiling point | 210 °C |
| Density | 0.885 g/mL at 25 °C(lit.) |
| vapor pressure | 30.3Pa at 25℃ |
| FEMA | 2031 | ALLYL HEPTANOATE |
| refractive index |
n |
| Flash point | 180 °F |
| storage temp. | under inert gas (nitrogen or Argon) at 2-8°C |
| solubility | soluble in Methanol |
| form | clear liquid |
| color | A colourless liquid. |
| Odor | at 100.00 %. sweet pineapple fruity waxy banana fusel cognac |
| Odor Type | fruity |
| Water Solubility | INSOLUBLE |
| JECFA Number | 4 |
| BRN | 8544440 |
| InChIKey | SJWKGDGUQTWDRV-UHFFFAOYSA-N |
| LogP | 3.97 at 20℃ |
| CAS DataBase Reference | 142-19-8(CAS DataBase Reference) |
| NIST Chemistry Reference | Allyl heptanoate(142-19-8) |
| EPA Substance Registry System | Allyl heptanoate (142-19-8) |
SAFETY
Risk and Safety Statements
| Symbol(GHS) |   GHS06,GHS09 |
|||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Signal word | Danger | |||||||||
| Hazard statements | H301+H311-H410 | |||||||||
| Precautionary statements | P264-P270-P273-P280-P301+P310-P302+P352+P312 | |||||||||
| Hazard Codes | Xn | |||||||||
| Risk Statements | 21/22-20/21/22 | |||||||||
| Safety Statements | 36/37 | |||||||||
| RIDADR | UN 2810 6.1/PG 3 | |||||||||
| WGK Germany | 3 | |||||||||
| RTECS | MJ1750000 | |||||||||
| TSCA | Yes | |||||||||
| HazardClass | 6.1 | |||||||||
| PackingGroup | III | |||||||||
| HS Code | 29159000 | |||||||||
| Toxicity | guinea pig,LD50,oral,444mg/kg (444mg/kg),BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY),Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964. | |||||||||
| NFPA 704 |
|
Allyl heptanoate price More Price(10)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Sigma-Aldrich(India) | W203111 | Allyl heptanoate natural, 98%, FG | 142-19-8 | 1SAMPLE-K | ₹5196 | 2022-06-14 | Buy |
| Sigma-Aldrich(India) | W203111 | Allyl heptanoate natural, 98%, FG | 142-19-8 | 100G | ₹6689.85 | 2022-06-14 | Buy |
| Sigma-Aldrich(India) | W203111 | Allyl heptanoate natural, 98%, FG | 142-19-8 | 1KG | ₹21455.15 | 2022-06-14 | Buy |
| Sigma-Aldrich(India) | W203111 | Allyl heptanoate natural, 98%, FG | 142-19-8 | 10KG | ₹105067.45 | 2022-06-14 | Buy |
| Sigma-Aldrich(India) | W203106 | Allyl heptanoate ≥97%, FCC, FG | 142-19-8 | 1SAMPLE-K | ₹4990.33 | 2022-06-14 | Buy |
Allyl heptanoate Chemical Properties,Uses,Production
Chemical Properties
Allyl heptanoate is a clear colourless liquid with characteristic wine odor and a slight banana note and banana-like flavor. It has been found in wild edible mushrooms. It is used in perfume compositions for apple-like (pineapple) notes. Insoluble in water, miscible with essential oils and perfume materials, poorly soluble in Propylene glycol. B.P. 210℃. Sp.Gr. 0.890,
Occurrence
Has apparently not been reported to occur in nature.
Uses
Allyl heptanoate was one of the first to be Flavor and Extract Manufacturers Association-registered GRAS (generally recognized as safe). It can be used as part of ester complexes, primarily in fruit flavors like apple, pineapple, pear, plum, banana, fruit punch, and tropicals such as kiwi, papaya and mango. It can also play an important role in the fruity notes of aged cheeses, especially Parmesan, Asiago and grana padano.
Preparation
Allyl heptanoate is manufactured by direct esterification of allyl alcohol with heptanoic acid in the presence of concentrated sulfuric acid.
Definition
ChEBI: Allyl heptanoate is a fatty acid ester.
General Description
Allyl heptanoate is a flavor and fragrance ingredient that may be present in karanda fruit. It has a fruity-pineapple, banana odour with mango and honey notes. It is widely used in tropical fruit composition; for perfumery applications the recommended usage level is up to 2%.
Safety Profile
Moderately toxic by ingestion and skin contact. A human skin irritant. See also ALL= COMPOUNDS and ESTERS. Combustible liquid. When heated to decomposition it emits acrid smoke and irritating fumes.
Metabolism
The hydrolysis of ester linkages in foreign compounds may be catalysed by many different esterases; most of these have a low degree of substrate specificity and they are to be found in all animals and bacteria(Parke, 1968). In the rat, allyl acetate and allyl alcohol are metabolized to 3-hydroxypropylmercapturic acid, which is excreted in the urine(Clapp, Kaye & Young, 1969). Heptanoic acid, like other odd-carbon fatty acids, is converted to glycogen with little or no formation of ketone bodies. The mechanism probably involves β-oxidation with formation of two acetic acid molecules plus one propionic acid molecule(Deuel, 1957).
Allyl heptanoate Preparation Products And Raw materials
| Supplier | Tel | Country | ProdList | Advantage | Inquiry |
|---|---|---|---|---|---|
| HJ AROCHEM | +91-8690768060 +91-9724420086 | Ahmedabad, India | 171 | 58 | Inquiry |
| BanChem Group | +91-9321395999 +91-9769361999 | Maharashtra, India | 26 | 58 | Inquiry |
| Silverline Chemicals | +91-9810339289 +91-9810339289 | Haryana, India | 71 | 58 | Inquiry |
| Mruchem | +91-8087147166 +91-8087147166 | Gujarat, India | 52 | 58 | Inquiry |
| Oriental Aromatics Ltd | +91-2243214000 +91-2266556000 | Maharashtra, India | 33 | 58 | Inquiry |
| Akshaya Laboratories Pvt. Ltd | -64642624 | Hyderabad, India | 125 | 58 | Inquiry |
| BanChem Group India | +91 251 244 8395 | Mumbai, India | 19 | 58 | Inquiry |
| Aroma Sales Corporation | 08068442234Ext 905 | Delhi, India | 131 | 58 | Inquiry |
| Fine Fragrances Private Limited | 08047622202 | Mumbai, India | 24 | 58 | Inquiry |
| Silverline Chemicals | 08048372772Ext 783 | Haryana, India | 61 | 58 | Inquiry |
| Supplier | Advantage |
|---|---|
| HJ AROCHEM | 58 |
| BanChem Group | 58 |
| Silverline Chemicals | 58 |
| Mruchem | 58 |
| Oriental Aromatics Ltd | 58 |
| Akshaya Laboratories Pvt. Ltd | 58 |
| BanChem Group India | 58 |
| Aroma Sales Corporation | 58 |
| Fine Fragrances Private Limited | 58 |
| Silverline Chemicals | 58 |
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