N,N'-Tetramethylen-bis-methansulfonamid | 13910-95-7

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机磺酸及其衍生物
• 英文名称: N,N'-Tetramethylen-bis-methansulfonamid
• 英文别名: N,N'-(Butane-1,4-diyl)dimethanesulfonamide；N-[4-(methanesulfonamido)butyl]methanesulfonamide
• CAS: 13910-95-7
• 化学式: C₆H₁₆N₂O₄S₂
• 分子量: 244.336
• InChiKey: AQKHJLBVTHJYKE-UHFFFAOYSA-N

物化性质

• 熔点：
  79-80 °C
• 沸点：
  407.5±55.0 °C(Predicted)
• 密度：
  1.304±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -0.9
• 重原子数：
  14
• 可旋转键数：
  7
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  109
• 氢给体数：
  2
• 氢受体数：
  6

安全信息

• 海关编码：
  2935009090

反应信息

• 作为反应物：
  描述：

  N,N'-Tetramethylen-bis-methansulfonamid 在 甲酸 、 sodium nitrite 作用下， 生成 N,N'-Tetramethylen-bis-(N-nitroso-methansulfonamid)
  参考文献：
  名称：

  Synthesis of Potential Anticancer Agents. XXI. Nitrosated Sulfonamides Related to Myleran

  摘要：

  DOI：

  10.1021/jo01073a024
• 作为产物：
  描述：

  甲基磺酰氯 、 四亚甲基二胺 在 potassium carbonate 作用下， 以 苯 为溶剂， 生成 N,N'-Tetramethylen-bis-methansulfonamid
  参考文献：
  名称：

  Synthesis of Potential Anticancer Agents. XXI. Nitrosated Sulfonamides Related to Myleran

  摘要：

  DOI：

  10.1021/jo01073a024

文献信息

• Quantitative structure–activity relationships studies for prediction of antimicrobial activity of synthesized disulfonamide derivatives
  作者：Saliha Alyar、Neslihan Özbek、Kübra Kuzukıran、Nurcan Karacan

  DOI：10.1007/s00044-010-9304-7

  日期：2011.3

  A new series of disulfonamides were synthesized and assayed as antimicrobial agents against Staphylococcus aureus, Bacillus cereus, and Escherichia coli. The quantitative structure-activity relationship analysis (QSAR) was applied to find out the correlation between experimentally evaluated antimicrobial activities with various parameters of the compounds using stepwise multiple liner regression method. The QSAR analysis revealed that the third-order average connectivity index ((3)chi(A)) was found to have negative correlation. The best QSAR models were further validated by leave-one-out method of cross-validation.
• Stabilized Standards for Busulfan Immunoassay
  申请人：Salamone Salvatore J.

  公开号：US20100068827A1

  公开（公告）日：2010-03-18

  Use of busulfan amide as stabilized standards in immunoassays for quantifying the amount of busulfan in samples of human biological fluids, methods for carrying out said immunoassay and kits for use in said immunoassay.
• STABILIZED STANDARDS FOR BUSULFAN IMMUNOASSAY
  申请人：Salamone Salvatore J.

  公开号：US20120225443A1

  公开（公告）日：2012-09-06

  Use of busulfan amide as stabilized standards in immunoassays for quantifying the amount of busulfan in samples of human biological fluids, methods for carrying out said immunoassay and kits for use in said immunoassay.
• US8039220B2
  申请人：——

  公开号：US8039220B2

  公开（公告）日：2011-10-18
• US8329416B2
  申请人：——

  公开号：US8329416B2

  公开（公告）日：2012-12-11