5,5-dimethyl-2-(methylthio)-1,3,2-dioxaphosphorinane, 2-oxide | 1005-98-7

• 分子结构分类: 有机化合物 - 有机磷化合物 - 有机硫代磷化合物
• 英文名称: 5,5-dimethyl-2-(methylthio)-1,3,2-dioxaphosphorinane, 2-oxide
• 英文别名: 5,5-Dimethyl-2-oxo-2-methylmercapto-1,3,2-dioxa-phosphorinan；5,5-Dimethyl-2-(methylsulfanyl)-1,3,2lambda~5~-dioxaphosphinan-2-one；5,5-dimethyl-2-methylsulfanyl-1,3,2λ5-dioxaphosphinane 2-oxide
• CAS: 1005-98-7
• 化学式: C₆H₁₃O₃PS
• 分子量: 196.207
• InChiKey: ROMHQCFXQKWRKE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.9
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  60.8
• 氢给体数：
  0
• 氢受体数：
  4

安全信息

• 海关编码：
  2934999090

反应信息

• 作为产物：
  描述：

  2-methoxy-5,5-dimethyl-1,3,2-dioxaphosphorinane 2-sulfide 以 苯甲腈 为溶剂， 生成 5,5-dimethyl-2-(methylthio)-1,3,2-dioxaphosphorinane, 2-oxide
  参考文献：
  名称：

  Reimschuessel, W.; Adamus, J., Phosphorus, Sulfur and Silicon and the Related Elements, 1990, vol. 51/52, p. 671

  摘要：

  DOI：

文献信息

• Cyclic organophosphorus compounds—II
  作者：R.S. Edmundson

  DOI：10.1016/s0040-4020(01)98496-0

  日期：1964.1

  The IR spectra of 47 1,3,2-dioxaphosphorinanes, mostly new compounds, have been recorded and discussed. Assignments have been made to PO, POC (alkyl and aryl), PS and PN stretching motions. In addition,it is suggested tentatively that multiple bands found at around 1000 to 1050 cm−1 and at around 1150 to 1200 cm−1 may be due to ring PO(C) vibrations.

  记录和讨论了47种1,3,2-二氧杂磷酰萘啉（主要是新化合物）的红外光谱。分配给P，O，POC（烷基和芳基），PS和PN拉伸运动。另外，初步建议在大约1000至1050 cm -1和大约1150至1200 cm -1处发现多个频带可能是由于环PO（C）振动所致。
• New synthesis of S(Se)-alkyl phosphorothio(seleno)lates from the corresponding phosphoroanilidates. Stereospecific cleavage of the phosphorus-nitrogen bond in chiral phosphoroanilidates
  作者：Wojciech J. Stec、Andrzej Okruszek、Kvystyna Lesiak、Bogdan Uznanski、Jan Michalski

  DOI：10.1021/jo00864a010

  日期：1976.1
• Bruzik, K. S.; Stec, W. J., Phosphorus and Sulfur and the Related Elements, 1988, vol. 35, p. 229 - 240
  作者：Bruzik, K. S.、Stec, W. J.

  DOI：——

  日期：——
• COMPOUNDS AND METHODS FOR TRANS-MEMBRANE DELIVERY OF MOLECULES
  申请人：Aposense LTD.

  公开号：US20160120996A1

  公开（公告）日：2016-05-05

  A novel delivery system for drugs, and especially macromolecules such as proteins or oligonucleotides through biological membranes is provided, and specifically delivery of siRNA. The delivery system comprises conjugation of the macromolecule drug to a moiety that enables effective passage through the membranes. Respectively, novel compounds and pharmaceutical compositions are provided, utilizing said delivery system. In one aspect of the invention, the compounds may be utilized in medical practice, for example, in delivery of siRNA or antisense oligonucleotides across biological membranes for the treatment of medical disorders.
• Reimschuessel, W.; Adamus, J., Phosphorus, Sulfur and Silicon and the Related Elements, 1990, vol. 51/52, p. 671
  作者：Reimschuessel, W.、Adamus, J.

  DOI：——

  日期：——