基本情報
- CAS
931-51-1- 標準SMILES
[CH-]1CCCCC1.[Cl-].[Mg+2]- InChIKey
WMJMABVHDMRMJA-UHFFFAOYSA-M- 分子式
- C6H11ClMg
- 平均分子量
- 142.91 g/mol
- 単同位体質量
- 142.0399697
名称と識別子
- 優先名称
- Cyclohexylmagnesium chloride
- IUPAC
- magnesium;cyclohexane;chloride
- 現地名
- クロロシクロヘキシルマグネシウム
- 英語名
- Cyclohexylmagnesium chloride
- 分子式
- C6H11ClMg
- 分子量
- 142.91
名称と別名
CYCLOHEXYLMAGNESIUM CHLORIDE931-51-1Magnesium, chlorocyclohexyl-ChlorocyclohexylmagnesiumHSDB 5772OAG686RDSUEINECS 213-237-1EC 213-237-1DTXSID2061309RefChem:580868Magnesium, chlorocyclohexylDTXCID4048856
名称をさらに表示
シクロヘキシルクロロマグネシウムクロロ(シクロヘキシル)マグネシウムクロロシクロヘキシルマグネシウムシクロヘキシルマグネシウムクロリドシクロヘキシルマグネシウムクロライドシクロヘキシルマグネシウムクロリド 溶液シクロヘキシルマグネシウムクロリド,THF/トルエン溶液,AcroSealＲCyclohexylchloromagnesiumchlorocyclohexyl-magnesiuMagnesiuM,chlorocyclohexyl-Cycohexylmagnesium chloridecyclohexylmagnesium chloride sol.Cyclohexylmagnesium chloride solutionCyclohexylmagnesium chloride, 1M in THFCYCLOHEXYLMAGNESIUM CHLORIDE(2.0MinTHF)
CYCLOHEXYLMAGNESIUM CHLORIDE [HSDB]213-237-1UNII-OAG686RDSUmagnesium;cyclohexane;chlorideCHLORO(CYCLOHEXYL)MAGNESIUMMFCD00003816cyclohexylmagnesiumchloridecyclohexyl magnesium chloride
データベース識別子
- CAS
931-51-1- PubChem CID
- 13605
- DTXSID
DTXSID2061309- EC Number
- 213-237-1
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
- 2
- 回転可能結合数
- 0
- 重原子数
- 8
- 形式電荷
- 0
- 複雑度
- 35.5
実験および物理化学的性質
Chemical ClassesMetals -> Metals, Organic Compounds
Physical DescriptionSolution in diethyl ether: Yellow-brown liquid; [MSDSonline]
Other Experimental Properties
Moisture sensitive
... May react violently with water. /Methyl magnesium bromide in ethyl ether/
物理化学的性質
- 比重(密度)
- 0.871 g/mL · 0.871 g/mL at 25 °C
- 闪点
- 40 °F · −40 °F
- 貯蔵温度
- 2 · 2-8°C
- 外見
- 解決
- 色
- クリアーなダークブラウン
- 水溶解度
- 水と激しく反応する。
- BRN
- 3535440 · 3535440
- InChI
- InChI=1S/C6H11.ClH.Mg/c1-2-4-6-5-3-1;;/h1H,2-6H2;1H;/q;;+1/p-1
- InChIKey
- WMJMABVHDMRMJA-UHFFFAOYSA-M
- SMILES
- [Mg](C1CCCCC1)Cl
- EPAの化学物質情報
- Magnesium, chlorocyclohexyl- (931-51-1)
化学的性質
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Danger
H225 (42.5%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 73 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory InformationREACH registered substance: Chlorocyclohexylmagnesium (EC: 213-237-1)
Hazards Summary
Apart from their instability in air and their caustic basic properties, organomagnesium compounds and the precipitated inorganic magnesium salts produced during their use display no pronounced toxicity or side effects of environmental concern. [Ullmann] Solution in diethyl ether: Reacts violently with water; A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may cause chemical pneumonitis and pulmonary edema; [MSDSonline]
DOT Emergency Guidelines
/GUIDE 138: SUBSTANCES - WATER-REACTIVE (EMITTING FLAMMABLE GASES)/ Fire or Explosion: Produce flammable gases on contact with water. May ignite on contact with water or moist air. Some react vigorously or explosively on contact with water. May be ignited by heat, sparks or flames. May re-ignite after fire is extinguished. Some are transported in highly flammable liquids. Runoff may create fire or explosion hazard. /Organometallic substance, liquid, water-reactive, flammable/
/GUIDE 138: SUBSTANCES - WATER-REACTIVE (EMITTING FLAMMABLE GASES)/ Health: Inhalation or contact with vapors, substance, or decomposition products may cause severe injury or death. May produce corrosive solutions on contact with water. Fire will produce irritating, corrosive and/or toxic gases. Runoff from fire control may cause pollution. /Organometallic substance, liquid, water-reactive, flammable/
化学と産業
用途と製造
Uses
Used as chemical intermediate; [HSDB]
CHEM INT, EG, FOR CYCLOHEXYLSILANE
Methods of ManufacturingREACTION OF CYCLOHEXYL CHLORIDE WITH MAGNESIUM IN ANHYDROUS DIETHYL ETHER, USUALLY IN THE PRESENCE OF AN INITIATOR
General Manufacturing InformationMagnesium, chlorocyclohexyl-: ACTIVE
応用分野
使用Cyclohexylmagnesium chloride is used as a Grignard reagent in greener solvent, 2-methyltetrahydrofuran (2-MeTHF). It is used as a reagent for the introduction of the cyclohexyl group; metalation of CH-acidic compounds.
上流・下流製品情報
下流製品
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