基本情報
- CAS
1746-03-8- 標準SMILES
C=CP(=O)(O)O- InChIKey
ZTWTYVWXUKTLCP-UHFFFAOYSA-N- 分子式
- C2H5O3P
- 平均分子量
- 108.03 g/mol
- 単同位体質量
- 107.99763101
名称と識別子
- 優先名称
- Poly(vinylphosphonic acid)
- IUPAC
- ethenylphosphonic acid
- 現地名
- ビニルホスホン酸
- 英語名
- Vinylphosphonic acid
- 分子式
- C2H5O3P
- 分子量
- 108.03
名称と別名
名称をさらに表示
データベース識別子
- CAS
1746-03-8- PubChem CID
- 168725
- DTXSID
DTXSID40862745- UNII
- FYU8Q3UC9N
- Nikkaji
- J203.156F
物性
構造計算による物性
- XLogP
- -1.1
- 極性表面積
- 57.5 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 3
- 回転可能結合数
- 1
- 重原子数
- 6
- 形式電荷
- 0
- 複雑度
- 91
物理化学的性質
- 融点
- 41 · 41-45 °C(lit.)
- 沸点
- 97 · 97-98 °C(Press: 2 Torr)
- 比重(密度)
- 1.389 g/mL · 1.389 g/mL at 25 °C(lit.)
- 蒸気圧
- 0 Pa · 0Pa at 20℃
- 屈折率
- 20 · n20/D 1.473
- 闪点
- 230 °F · >230 °F
- 貯蔵温度
- Sealed in dry,Room Temperature
- 溶解性
- Soluble in water
- 酸解離定数(Pka)
- 2.11 · 2.11±0.10(Predicted)
- 外見
- 液体
- 色
- 無色~淡黄色
- PH
- 1.5 · 1.5 (50g/l, H2O, 30℃)
- 水溶解度
- 100 g/L · 100g/L at 20℃
- BRN
- 1741622 · 1741622
- InChI
- 1S/C2H5O3P/c1-2-6(3,4)5/h2H,1H2,(H2,3,4,5)
- InChIKey
- ZTWTYVWXUKTLCP-UHFFFAOYSA-N
- SMILES
- OP(O)(=O)C=C
- LogP
- -1.69 at · -1.69 at 20℃
- CAS データベース
- 1746 · 1746-03-8(CAS DataBase Reference)
- EPAの化学物質情報
- Phosphonic acid, ethenyl- (1746-03-8)
安全と法規制
安全データ
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- SZ7903500
- ridadr
- UN 3261 8/PG 2
- hs_code
- 2931499090
- risk_code
- 34-35-22
- 消防法
- 危-4-3-III
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- hazard_class
- 8
- packing_group
- III
- Hazard Classifications
- Met. Corr. 1Skin Corr. 1B
- ストレージクラス
- 8A - Combustible corrosive hazardous materials
化学と産業
応用分野
使用Vinylphosphonic acid (VPA) can be used as a monomer unit for the synthesis of poly(vinylphosphonic acid) via free radical polymerization. It is also used to develop copolymers of VPA with acrylonitrile, N-isopropylacrylamide, styrene, vinylpyrrolidone, and acrylic and methacrylic acid. These copolymers find potential application in hydrogels, drug delivery, biomimetic mineralization, and polymer electrolyte membranes in fuel cells. It can also be used as an organic building block to prepare (E)-styryl phosphonic acid derivatives by reacting with various aryl halides via Pd-catalyzed Heck coupling reaction.
一般的な説明Vinylphosphonic acid (VPA) is an organophosphorus compound that is used in the surface treatment of metal substrates. It can be used in the preparation of poly(VPA) by radical polymerization in the presence of initiator systems and chain transfer agents. PVPA tends to have an electrolytic nature, which is useful for a variety of energy based applications.
調製方法
純化方法This fireproofing agent, and ingredient for making polymers, is obtained as a syrup on hydrolyzing vinylphosphonyl dichloride with cold H2O and solidifies on prolonged drying over P2O5/KOH. When distilled at 235-240o/0.0006mm, it gives the anhydride (d 1.304, n 1.5874) [Kabachnik & Medvedi Izvest Akad Nauk SSSR, Ser Khim 868 1953, Chem Abstr 54 10834 1960]. It is best kept as the sodium salt (m 350o) which precipitates when a solution of EtOH containing NaOEt (from 2g of Na) is added to vinylphosphonic acid (3.2g), and is recrystallised from EtOH (5.1g, quantitative). The p-anisidinium salt forms mauve prisms m 250o (from EtOH/Et2O). The dimethyl ester, M 136.1, d4 1.1405, nD 1.4330, has b 72.5o/10mm and 197-202o/760mm. [Kabachnik et al. J Gen Chem USSR (Engl Trans) 33 375 1963, Beilstein 4 IV 3568.]
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