(2H5)ethylphosphonoyl dichloride

• ChemBase编号: 168709
• 分子式: C2H5Cl2OP
• 平均质量: 146.940261
• 单一同位素质量: 145.94550677
• SMILES: O=P(CC)(Cl)Cl
• Canonical SMILES: CCP(=O)(Cl)Cl
• InChI: InChI=1S/C2H5Cl2OP/c1-2-6(3,4)5/h2H2,1H3
• InChIKey: OWGJXSYVHQEVHS-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: (^2H₅)ethylphosphonoyl dichloride
• IUPAC传统名: (^2H₅)ethylphosphonoyl dichloride
• 别名: Ethyl-d5-phosphonic Acid Dichloride; Ethyl-d5-phosphonyl Dichloride; Dichloro(ethyl-d5)phosphine Oxide; Ethyl-d5-phosphonic Dichloride

登记号

• PubChem SID: 162262841
• PubChem CID: 71316652

理论计算性质

• 质子受体: 1
• 质子供体: 0
• LogD (pH = 5.5): 1.1186616
• LogD (pH = 7.4): 1.1186616
• Log P: 1.1186616
• 摩尔折射率: 29.1938 cm^3
• 极化性: 11.655576 Å^3
• 极化表面积: 17.07 Å^2
• 可自由旋转的化学键: 1
• 里宾斯基五规则: true

详细说明

Toronto Research Chemicals - E925392

A labelled organophosphorus compound. It is used in the preparation of cellulose phosphinates as fireproofing agents.

参考文献

• Yurchenko, V.M. et al.: Koks. Kim., 4, 37 (1980)
• Kiselev, A.D. et al.: Zhur. Prik. Khim., 46, 909 (1980)