2-ペンタノール(6032-29-7)

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2-ペンタノール 製品概要
化学名:2-ペンタノール
英語化学名:2-Pentanol
别名:(+/-)-2-PENTANOL;1-Methylbutanol;alcoold’amylesecondaire;Isoamyl alcohol, secondary;isoamylalcohol(secondary);isoamylalcohol,secondary;n-C3H7CH(OH)CH3;sek.-Amylalkohol
CAS番号:6032-29-7
分子式:C5H12O
分子量:88.15
EINECS:227-907-6
カテゴリ情報:Alcohols;Building Blocks;C2 to C6;Chemical Synthesis;Organic Building Blocks;Oxygen Compounds;alcohol Flavor;bc0001
Mol File:6032-29-7.mol
2-ペンタノール
2-ペンタノール 物理性質
融点 -50 °C
沸点 118-119 °C (lit.)
比重(密度) 0.812 g/mL at 25 °C (lit.)
蒸気密度3 (vs air)
蒸気圧3 hPa (20 °C)
屈折率 n20/D 1.406(lit.)
FEMA 3316 | 2-PENTANOL
闪点 93 °F
貯蔵温度 Store below +30°C.
溶解性166g/l
外見 Liquid
酸解離定数(Pka)15.31±0.20(Predicted)
Clear colorless
Relative polarity0.488
臭い (Odor)at 100.00 %. mild green fusel oil fermented
においのタイプfermented
爆発限界(explosive limit)1.2-10.5%(V)
臭気閾値(Odor Threshold)0.29ppm
水溶解度 16.6 g/ 100 mL (20 ºC)
JECFA Number280
Merck 14,7119
BRN 1718819
Dielectric constant13.8(22℃)
InChIKeyJYVLIDXNZAXMDK-UHFFFAOYSA-N
LogP1.22
CAS データベース6032-29-7(CAS DataBase Reference)
NISTの化学物質情報2-Pentanol(6032-29-7)
EPAの化学物質情報2-Pentanol (6032-29-7)
安全性情報
主な危険性 Xn
Rフレーズ 10-20-37-66
Sフレーズ 46
RIDADR UN 1105 3/PG 3
WGK Germany 1
RTECS 番号SA4900000
自然発火温度649 °F
TSCA Yes
国連危険物分類 3
容器等級 III
HSコード 29051500
毒性LD50 orally in Rabbit: 1470 mg/kg LD50 dermal Rabbit 5250 mg/kg
MSDS Information
ProviderLanguage
2-Pentanol English
SigmaAldrich English
ACROS English
ALFA English
2-ペンタノール Usage And Synthesis
外観無色~ほとんど無色, 澄明の液体
溶解性エタノール及びアセトンに極めて溶けやすく、水に溶けやすい。
用途香料・香辛料
化学的特性Amyl alcohols (pentanols) have eight isomers. All are flammable, colorless liquids, except the isomer 2,2- dimethyl-1-propanol, which is a crystalline solid.
化学的特性clear colourless liquid
化学的特性2-Pentanol has a mild green, fusel-oil odor. This compound is also reported as having a winy, ethereal odor.
天然物の起源Reported found in banana, Satsuma mandarin peel oil, peach, raw asparagus, vinegar, wheaten bread, cheddar cheese, Swiss cheese, other cheeses, roasted barley, roasted filbert, roasted peanut, plum brandy, Bourbon vanilla, Chinese quince, apple, orange juice, bilberry, cranberry, guava, grapes, melon, papaya, pineapple, strawberry, ginger, butter, chicken fat, hop oil, beer, cognac, Scotch whiskey, rum, cider, red wine, cocoa, tea, oats, honey, soybean, coconut meat, passion fruit, beans, mushroom, starfruit, mango, malt, mountain papaya, endive, shrimp, naranjilla fruit and cape gooseberry.
使用(±)-2-Pentanol is a widely used solvent and a building block used in the synthesis of consumer products.
使用2-Pentanol is a secondary alcohol that can be used as:
  • A hydrogen donor in the synthesis of methyl furan via catalytic transfer hydrogenation of furfural over a ruthenium/ruthenium oxide/carbon catalyst.
  • A reagent in one-pot synthesis of brominated derivatives of 1,3-dioxolane.
  • A solvent for the synthesis of organic molecules such as 2, 4-diaminopyrimidines and 4-aza-podophyllotoxins.

製造方法By catalytic reduction of methyl n-propyl ketone.
定義ChEBI: A secondary alcohol that is pentane substituted at position 2 by a hydroxy group.
一般的な説明2-Pentanol, a secondary alcohol, is a volatile organic compound (VOC) that is a common aroma-active component of food and beverage products.
安全性プロファイルModerately toxic by ingestion and intraperitoneal routes. A narcotic. A skin and severe eye irritant. Flammable liquid when exposed to heat or flame; can react with oxidzing materials. A severe explosion hazard when exposed to heat or flame. To fight fire, use alcohol foam, dry chemical. When heated to decomposition it emits acrid smoke and irritating fumes. See also ALCOHOLS
職業ばく露(n-isomer); Suspected reprotoxic hazard, Primary irritant (w/o allergic reaction), (iso-, primary): Possible risk of forming tumors, Primary irritant (w/o allergic reaction), (sec-, active primary-, and other isomers) Primary irritant (w/o allergic reaction). Used as a solvent in organic synthesis and synthetic flavoring, pharmaceuticals, corrosion inhibitors; making plastics and other chemicals; as a flotation agent. The (n-isomer) is used in preparation of oil additives, plasticizers, synthetic lubricants, and as a solvent.
輸送方法UN2811 Pentanols, Hazard Class: 3; Labels: 3- Flammable liquid. UN1987 Alcohols, n.o.s., Hazard Class: 3; Labels: 3-Flammable liquid.
純化方法Refluxed it with CaO, distil it, then reflux it with magnesium and again fractionally distil it. [Beilstein 1 IV 1655.]
不和合性Forms an explosive mixture with air. Contact with strong oxidizers and hydrogen trisulfide may cause fire and explosions. Incompatible with strong acids. Violent reaction with alkaline earth metals forming hydrogen, a flammable gas.
廃棄物の処理Dissolve or mix the material with a combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber. All federal, state, and local environmental regulations must be observed.
Tags:6032-29-7