概要
Butyllithium is an alkyllithium compound.
名称と識別子
- 優先名称
- n-Butyl lithium
- IUPAC
- lithium butane
- 現地名
- ブチルリチウム
- 英語名
- n-Butyllithium
- 分子式
- C4H9Li
- 分子量
- 64.06
名称と別名
名称をさらに表示
データベース識別子
- CAS
109-72-8- PubChem CID
- 61028
- ChEBI
CHEBI:51469- UNII
- 09W9A6B8ZC
- Nikkaji
- J370K
物性
構造計算による物性
- 極性表面積
- 0 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 1
- 回転可能結合数
- 1
- 重原子数
- 5
- 形式電荷
- 0
- 複雑度
- 7.6
物理化学的性質
- 融点
- -95 °C · -95 °C
- 沸点
- 80 °C · 80 °C
- 比重(密度)
- 0.68 g/mL · 0.68 g/mL at 20 °C
- 蒸気圧
- 163 hPa · 163 hPa ( 20 °C)
- 闪点
- 10 °F · 10 °F
- 貯蔵温度
- 2 · 2-8°C
- 溶解性
- ジエチルエーテルおよびシクロヘキサンと混和します。
- 外見
- 液体
- 色
- 黄色
- 比重
- 0.695 · 0.695
- 臭い (Odor)
- 溶剤臭
- 爆発限界(explosive limit)
- 1.2 · 1.2-7.8% (v/v)
- 水溶解度
- 激しい反応
- BRN
- 1209227 · 1209227
- InChI
- 1S/C4H9.Li/c1-3-4-2;/h1,3-4H2,2H3;
- InChIKey
- MZRVEZGGRBJDDB-UHFFFAOYSA-N
- SMILES
- [Li]CCCC
- LogP
- 1.25 · 1.25-2.31
- CAS データベース
- 109 · 109-72-8(CAS DataBase Reference)
- NISTの化学物質情報
- Butyl lithium(109-72-8)
- EPAの化学物質情報
- Lithium, butyl- (109-72-8)
化学的性質
化学的特性n-Butyllithium is a colorless crystalline solid or clear yellow solution. Due to its high reactivity and extreme solubility, even in its impurities, it is commonly thought to be a viscous liquid.
安全と法規制
危険有害性情報
CSL Reaction Information
CSL00127
Perfluorethyllithium + Phosphorus Trichloride,Phosphorus + N-BUTYLLITHIUM + CHLOROPENTAFLUOROETHANE
Avoid temperatures below -90 C
Substitution
Several times in our laboratory, we have experienced a violent decomposition of the ethereal C2F5Cl/n-BuLi solution after the addition of just a few drops of (R)nPCl3=n. In each of these cases, the metal-halogen exchange temperature was maintained below -90 C. We believe that this problem is due to a buildup of starting reagents at low temperatures.
C&EN
安全データ
- F
- 3-10
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 3399 4.3/PG 1
- 毒性
- There is little toxicity data available for the butyllithiums; for data on ether and hydrocarbon solvents, see the appropriate LCSSs.
- PRTR法
- 1-392
- hs_code
- 29319090
- risk_code
- 14/15-17-34-48/20-51/53-62-65-67-63-35-11-15-50/53-66
- 化審法
- 優先評価化学物質
- 安衛法
- 有機則 第二種有機溶剤等
- 消防法
- 危-3-II
- hazard_code
- F,C,N
- safety_code
- 6-9-16-26-36/37/39-45-61-62-6A-46-43B-43-60-33-29-5
- hazard_class
- 4.3
- packing_group
- I
- 自然発火温度
- 240°C
- Hazard Classifications
- Aquatic Chronic 2Asp. Tox. 1Eye Dam. 1Flam. Liq. 2Pyr. Liq. 1Skin Corr. 1BSTOT SE 3Water-react 1
- ストレージクラス
- 4.2 - Pyrophoric and self-heating hazardous materials
化学と産業
応用分野
用途有機合成試薬。
用途共役ジエンのアニオン重合開始剤、飽和および不飽和カルボニル化合物のアルキル化反応などに用いられる。
使用n-Butyllithium is used as a polymerization initiator in the production of elastomers like polybutadiene and styrene- butadiene- styrene. As a strong base, it is utilized in the synthesis of organic compounds. It undergoes thermal decomposition to prepare 1-butene.
調製方法
製造方法Industrially, n-butyllithium is produced by the reaction of n-butyl chloride with lithium metal dispersion in various hydrocarbon solvents. Hexane is the most commonly used solvent. Up to one-half of the lithium is replaced with sodium in order to lower the cost of the butyllithium and increase the reactivity of the dispersion. The reaction is carried out below the boiling point of the solvent.The laboratory procedure is essentially the same except that pentane and diethyl ether are two of the more popular solvents. The preparation runs smoothly in ether at lower temperatures but the product must either be used immediately or kept refrigerated due to the rapid cleavage of ether by n-butyllithium.
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