基本情報
- CAS
40244-90-4- 標準SMILES
CC(C)P(Cl)C(C)C- InChIKey
JZPDBTOWHLZQFC-UHFFFAOYSA-N- 分子式
- C6H14ClP
- 平均分子量
- 152.6 g/mol
- 単同位体質量
- 152.0521651
名称と識別子
- 優先名称
- Chlorodiisopropylphosphine
- IUPAC
- chloro-di(propan-2-yl)phosphane
- 現地名
- クロロジイソプロピルホスフィン
- 英語名
- Chlorodiisopropylphosphine
- 分子式
- C6H14ClP
- 分子量
- 152.6
名称と別名
名称をさらに表示
データベース識別子
- CAS
40244-90-4- PubChem CID
- 538967
- DTXSID
DTXSID10337132- UNII
- 5FG5N54CYB
- EC Number
- 629-426-0
- Nikkaji
- J121.063G
物性
構造計算による物性
- XLogP
- 2.3
- 極性表面積
- 0 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 0
- 回転可能結合数
- 2
- 重原子数
- 8
- 形式電荷
- 0
- 複雑度
- 53
物理化学的性質
- 沸点
- 69 °C33 · 69 °C33 mm Hg(lit.)
- 比重(密度)
- 0.959 g/mL · 0.959 g/mL at 25 °C(lit.)
- 屈折率
- 20 · n20/D 1.475(lit.)
- 闪点
- 39 °F · 39 °F
- 貯蔵温度
- Refrigerator
- 外見
- 液体
- 色
- クリアライトイエロー
- InChI
- InChI=1S/C6H14ClP/c1-5(2)8(7)6(3)4/h5-6H,1-4H3
- InChIKey
- JZPDBTOWHLZQFC-UHFFFAOYSA-N
- SMILES
- P(C(C)C)(C(C)C)Cl
- CAS データベース
- 40244 · 40244-90-4(CAS DataBase Reference)
化学的性質
化学的特性Colorless to light yellow liqui
安全と法規制
GHS分類
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids];H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 42 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
危険有害性情報
安全データ
- wgk
- 3
- ridadr
- UN 2924 3/PG 2
- hs_code
- 29310099
- risk_code
- 11-34
- 消防法
- 危-4-1-II
- hazard_code
- F,C
- safety_code
- 16-26-27-36/37/39-45-1
- hazard_class
- 3.1
- packing_group
- II
- Hazard Classifications
- Flam. Liq. 2Skin Corr. 1B
- ストレージクラス
- 3 - Flammable liquids
化学と産業
応用分野
説明Chlorodiisopropylphosphine is an organophosphorus compound of particular interest in synthetic chemistry, where it is used as a reagent in the preparation of phosphine ligands for transition metal complexes. Its utility in synthesising these complexes is due to the reactivity of the chloro group, which other groups can substitute to create a diverse array of ligands. This reactivity is also exploited in the study of catalysis, as the resulting phosphine ligands can be used to modulate the activity and selectivity of metal catalysts. In addition, Chlorodiisopropylphosphine is investigated for its potential in forming new organophosphorus compounds with applications in materials science. Researchers are also interested in the compound′s role in synthesising flame retardants, where its phosphorus content could contribute to the material′s flame-retarding properties.
使用Chlorodiisopropylphosphine can be used: To synthesize p-styryldiisopropylphosphine by reacting with 4-chlorostyrene via Grignard reaction.As a phosphination reagent in combination with [Cp2Zr(1-butene)(DMAP)] (Cp=cyclopentadienyl; DMAP= 4-(dimethylamino)pyridine)) for the zirconophosphination of alkynes to form zirconoalkenylphosphines.A luminescent mixed-donor platinum POCN pincer complex via cyclometalation process.
調製方法
合成方法PCl3のエーテル溶液にイソプロピルマグネシウムクロリドを加える。
上流・下流製品情報
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