酢酸ヘキシル(142-92-7)

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酢酸ヘキシル 製品概要
化学名:酢酸ヘキシル
英語化学名:Hexyl acetate
别名:HEXYLACETATE(SG);Hexylacetat;HEXYLACETATE WITH GC;HEXYL ACETATE, NATURAL;Hexvl acetate;1-Hexylethanoate;1-Hexanol acetate;Acetic acid hexyl
CAS番号:142-92-7
分子式:C8H16O2
分子量:144.21
EINECS:205-572-7
カテゴリ情報:Alcohol Acetates;Biochemicals and Reagents;Building Blocks;C8 to C9;Carbonyl Compounds;Chamaemelum nobile (Chamomile tea);Chemical Synthesis;Esters;Fatty Acyls;Fatty Esters;Lipids;Nutrition Research;Organic Building Blocks;Phytochemicals by Plant (Food/Spice/Herb);Pharmaceutical Intermediates
Mol File:142-92-7.mol
酢酸ヘキシル
酢酸ヘキシル 物理性質
融点 ?80 °C (lit.)
沸点 168-170 °C (lit.)
比重(密度) 0.87 g/mL at 25 °C (lit.)
蒸気圧5 hPa (20 °C)
FEMA 2565 | HEXYL ACETATE
屈折率 n20/D 1.409(lit.)
闪点 99 °F
貯蔵温度 Store below +30°C.
溶解性0.4g/l
外見 Liquid
Clear colorless to pale yellow
臭い (Odor)at 10.00 % in dipropylene glycol. fruity green apple banana sweet
においのタイプfruity
臭気閾値(Odor Threshold)0.0018ppm
水溶解度 immiscible
JECFA Number128
BRN 1747138
Dielectric constant4.4199999999999999
LogP3.3 at 30℃
CAS データベース142-92-7(CAS DataBase Reference)
NISTの化学物質情報Hexyl ethanoate(142-92-7)
EPAの化学物質情報Acetic acid, hexyl ester (142-92-7)
安全性情報
Rフレーズ 10
Sフレーズ 16
RIDADR UN 3272 3/PG 3
WGK Germany 1
RTECS 番号AI0875000
TSCA Yes
国連危険物分類 3
容器等級 III
HSコード 29153990
有毒物質データの142-92-7(Hazardous Substances Data)
毒性LD50 orally in Rabbit: 36100 mg/kg LD50 dermal Rabbit > 5000 mg/kg
MSDS Information
ProviderLanguage
Hexyl acetate English
SigmaAldrich English
ACROS English
ALFA English
酢酸ヘキシル Usage And Synthesis
外観無色澄明の液体
定義本品は、次の化学式で表される有機化合物である。
溶解性水に難溶 (0.13g/100ml水, 20℃)。エタノール, 有機溶剤に易溶。エタノール及びアセトンに溶けやすく、水に極めて溶けにくい。
用途セルロースエステルの溶剤、その他の樹脂。香料成分、芳香成分。
化粧品の成分用途溶剤、香料、香味剤
説明Hexyl acetate has a pleasant fruity odor and bittersweet taste suggestive of pear. May be synthesized from n-hexyl alcohol and excess acetic anhydride at the boil or with an excess of acetic acid in the presence of concentrated sulfuric acid.
化学的特性Hexyl Acetate is a liquid with a sweet-fruity, pear-like odor. It is present in a number of fruits and alcoholic beverages and is used in fruit aroma compositions.
化学的特性clear colorless to pale yellowish liquid
化学的特性Hexyl acetate has a pleasant fruity, apple, cherry, pear, floral odor and bittersweet taste suggestive of pear.
天然物の起源Reported found in fruital aromas (e.g., Fragaria vesca) and essential oils. Also reported found in apple, apricot, banana, sweet cherry, citrus peel oils and juices, blueberry, black currants, guava, grapes, melon, peach, pear, raspberry, blackberry, strawberry, peas, sauerkraut, rye bread, cheeses, roasted beef, beer, rum, cognac, whiskies, cider, sherry, grape wines, coffee, tea, soybean, olive, passion fruit, beans, starfruit, mango, cauliflower, pear and apple brandy, quince, origanum, lovage leaf, corn oil, mangosteen (Garcia mangostana), Bourbon vanilla, clary sage, nectarine, naranjilla fruit, Chinese quince and chamomile oil.
使用n-Hexyl acetate exhibits antimicrobial activity and can be used to improve the safety of minimally processed fruits. It is a fruity smelling fluid used as flavoring agent or in perfumes. It is a green leaf volatile from cabbage Brassica oleracea var. capitata L. It is used as plasticizers.
使用Hexyl Acetate is a flavouring agent due to its fruity odor and it is naturally present in many fruits and alcoholic beverages.
使用Hexyl acetate was used to study the activity of diamondback moth sex pheromone and larval frass volatiles, as well as green leaf volatiles from cabbage, on the natural enemies of the pest.
定義ChEBI: The acetate ester of hexan-1-ol.
調製方法n-Hexyl acetate is prepared from n-hexyl alcohol and excess acetic anhydride or with an excess of acetic acid and concentrated sulfuric acid . Its is also prepared from primary and sec-hexyl alcohols .
It is produced by Aldrich Chemical Corp., Milwaukee, WI, and Penta Manufacturing Co., Fairfield, NJ .
製造方法From n-hexyl alcohol and excess acetic anhydride at the boil or with an excess of acetic acid in the presence of concentrated sulfuric acid
Aroma threshold valuesDetection: 2 to 480 ppb
Taste threshold valuesTaste characteristics at 15 ppm: fruity, green, fresh, sweet, banana peel, apple and pear.
Synthesis Reference(s)Tetrahedron Letters, 18, p. 3263, 1977 DOI: 10.1016/S0040-4039(01)83213-5
一般的な説明A colorless liquid with a mild sweet odor. Flash point 113°F. A moderate fire risk. Inhalation may cause adverse effects. Insoluble in water and very soluble in alcohols and ethers. When heated to high temperatures emits acrid smoke and fumes. Used as a solvent and as a propellant in aerosols.
空気と水の反応Highly flammable. Insoluble in water.
反応プロフィールHexyl acetate is an ester. Esters react with acids to liberate heat along with alcohols and acids. Strong oxidizing acids may cause a vigorous reaction that is sufficiently exothermic to ignite the reaction products. Heat is also generated by the interaction of esters with caustic solutions. Flammable hydrogen is generated by mixing esters with alkali metals and hydrides.
危険性Combustible.
健康ハザードMay be harmful by inhalation, ingestion, or skin absorption. May cause irritation.
火災危険Special Hazards of Combustion Products: Vapor may travel considerable distance to a source of ignition and flash back. Container explosion may occur under fire conditions. Forms explosive mixtures in air.
燃焼性と爆発性Flammable
Biochem/physiol ActionsHexyl acetate has antimicrobial activity and can be used to improve the safety of minimally processed fruits. Hexyl acetate is a fruity smelling fluid used as flavoring agent or in perfumes. Hexyl acetate is a green leaf volatile from cabbage Brassica oleracea var. capitata L.
Tags:142-92-7