[bis(diethylamino)phosphanyl]diethylamine

• ChemBase编号: 147503
• 分子式: C12H30N3P
• 平均质量: 247.360461
• 单一同位素质量: 247.21773461
• SMILES: CCN(CC)P(N(CC)CC)N(CC)CC
• Canonical SMILES: CCN(P(N(CC)CC)N(CC)CC)CC
• InChI: InChI=1S/C12H30N3P/c1-7-13(8-2)16(14(9-3)10-4)15(11-5)12-6/h7-12H2,1-6H3
• InChIKey: FDIOSTIIZGWENY-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: [bis(diethylamino)phosphanyl]diethylamine
• IUPAC传统名: [bis(diethylamino)phosphanyl]diethylamine
• 别名: 六乙基亚磷酰三胺; 三(二乙氨基)膦; Hexaethyltriamidophosphite; Hexaethyltriaminophosphine; Phosphorous acid tris(diethylamide); Tris(N,N-diethylamino)phosphine; Tris(diethylamido)phosphine; Hexaethylphosphorous triamide; Tris(diethylamino)phosphine; N,N,N',N',N'',N''-Hexaethylphosphinetriamine; Tris(diethylamino)phosphine; Hexaethyl phosphorous triamide

登记号

• CAS号: 2283-11-6
• EC号: 218-920-8
• MDL号: MFCD00009041
• Beilstein号: 636187
• PubChem SID: 24855300; 162241691
• PubChem CID: 75292

理论计算性质

• 质子受体: 3
• 质子供体: 0
• LogD (pH = 5.5): 0.3000386
• LogD (pH = 7.4): 0.30775365
• Log P: 1.7504
• 摩尔折射率: 77.0078 cm^3
• 极化性: 30.152348 Å^3
• 极化表面积: 9.72 Å^2
• 可自由旋转的化学键: 9
• 里宾斯基五规则: true

分子性质

理化性质

• 沸点: 245-246°C; 80-90 °C/10 mmHg(lit.)
• 闪点: 138.2 °F; 58°C(136°F); 59 °C
• 密度: 0.903; 0.903 g/mL at 25 °C(lit.)
• 折射率: 1.4737; n20/D 1.475; n20/D 1.475(lit.)

安全信息

• 保存注意事项: Air Sensitive
• 欧盟危险性物质标志: 刺激性(Irritant) (Xi)
• 联合国危险货物编号: 1993; UN1993
• 德国WGK号: 3
• 联合国危险货物等级: 3
• 联合国危险货物包装类别(PG): 3; III
• 危险公开号: 36/37/38
• 安全公开号: 23-26-37; 26
• TSCA收录: 是
• GHS危险品标识: GHS02; GHS07
• GHS警示词: Warning
• GHS危险声明: H226-H315-H319-H335
• GHS警示性声明: P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A; P261-P305 + P351 + P338
• 个人保护装置: Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 1993 3/PG 3

产品相关信息

• 纯度: ≥90% (GC); 97%
• 级别: technical
• 线性分子式: P[N(C2H5)2]3

详细说明

Sigma Aldrich - 253189

包装
5, 25 g in glass bottle

Sigma Aldrich - 93329

Caution
长期储存可能产生沉淀

参考文献

• Reducing agent, compare Hexamethylphosphorous triamide, A12571.
• For use in the Barton syntheses of hindered alkenes, involving desulfurization of small-ring heterocycles with elimination of nitrogen or carbon dioxide, see: Chem. Commun., 1225, 1226 (1970):
  
• Reagent for selective vicinal dehalogenation of halogenated alkanes to give perhalogenated alkenes. The method has potential for the synthesis of highly fluorinated and mixed fluoro-halo alkenes: J. Org. Chem., 57, 5018 (1992).