4-氨基丁烷-1-磷酸 | 35622-27-6

• 物质功能分类: 生物化工 - 氨基酸及其衍生物 - 其他氨基酸衍生物
• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机膦酸及其衍生物
• 中文名称: 4-氨基丁烷-1-磷酸
• 中文别名: 4-氨基丁基磷酸
• 英文名称: 4-aminobutylphosphonic acid
• 英文别名: 4-azaniumylbutyl(hydroxy)phosphinate
• CAS: 35622-27-6
• 化学式: C₄H₁₂NO₃P
• mdl: MFCD00063426
• 分子量: 153.118
• InChiKey: IDPXFPYGZRMMKZ-UHFFFAOYSA-N

物化性质

• 熔点：
  133-134 °C
• 沸点：
  344.2±44.0 °C(Predicted)
• 密度：
  1.304±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -4.1
• 重原子数：
  9
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  83.6
• 氢给体数：
  3
• 氢受体数：
  4

安全信息

• 危险等级：
  8
• 危险品标志：
  Xi
• 安全说明：
  S26,S36
• 危险类别码：
  R36/37/38
• WGK Germany：
  3
• 危险品运输编号：
  UN 3261
• 海关编码：
  2931900090
• 包装等级：
  III
• 危险标志：
  GHS07
• 危险性描述：
  H315,H319,H335
• 危险性防范说明：
  P261,P305 + P351 + P338

反应信息

• 作为反应物：
  描述：

  4-氨基丁烷-1-磷酸 在 magnesium(II) nitrate hexahydrate 作用下， 以 水 为溶剂， 生成
  参考文献：
  名称：

  Multifunctional Phosphate-Based Inorganic–Organic Hybrid Nanoparticles

  摘要：

  Phosphate-based inorganic-organic hybrid nanoparticles (IOH-NPs) with the general composition [M](2+)[R-function(O)PO3](2-) (M = ZrO, Mg2O; R = functional organic group) show multipurpose and multifunctional properties. If [R-function(O))PO3](2-) is a fluorescent dye anion ([RdyeOPO3](2-)), the IOH-NPs show blue, green, red, and near-infrared fluorescence. This is shown for [ZrO](2+)[PUP](2-), [ZrO](2+)[MFP](2-), [ZrO](2+)[RRP](2-), and [ZrO](2+)[DUT](2-) (PUP = phenylumbelliferon phosphate, MFP = methylfluorescein phosphate, RRP = resorufin phosphate, DUT = Dyomics-647 uridine triphosphate). With pharmaceutical agents as functional anions ([RdrugOPO3](2-)), drug transport and release of anti-inflammatory ([ZrO](2+)[BMP](2-)) and antitumor agents ([ZrO](2+)[FdUMP](2-)) with an up to 80% load of active drug is possible (BMP = betamethason phosphate, FdUMP = 5'-fluoro-2'-deoxyuridine 5'-monophosphate). A combination of fluorescent dye and drug anions is possible as well and shown for [ZrO](2+)[BMP](2-)(0.996)[DUT](2-)(0.004). Merging of functional anions, in general, results in [ZrO](2+)([RdrugOPO3](1-x)[RdyeOPO3](x))(2-) nanoparticles and is highly relevant for theranostics. Amine-based functional anions in [MgO](2+)[RaminePO3](2-) IOH-NPs, finally, show CO2 sorption (up to 180 mg g(-1)) and can be used for CO2/N-2 separation (selectivity up to alpha = 23). This includes aminomethyl phosphonate [AMP](2-), 1-aminoethyl phosphonate [1AEP](2-), 2-aminoethyl phosphonate [2AEP](2-), aminopropyl phosphonate [APP](2-), and aminobutyl phosphonate [ABP](2-). All [M](2+)[R-function(O)PO3](2-) IOH-NPs are prepared via noncomplex synthesis in water, which facilitates practical handling and which is optimal for biomedical application. In sum, all IOH-NPs have very similar chemical compositions but can address a variety of different functions, including fluorescence, drug delivery, and CO2 sorption.

  DOI：

  10.1021/jacs.5b01172
• 作为产物：
  描述：

  diethyl 4-aminobutylphosphonate 在 盐酸 、 methyloxirane 作用下， 生成 4-氨基丁烷-1-磷酸
  参考文献：
  名称：

  Borane Reduction of Dialkoxyphosphorylcarboxamides as a New Route to Aminoalkylphosphonic Acids

  摘要：

  一种新的简单合成氨基烷基膦酸的方法是基于用硼烷-二甲基硫化物复合物还原二烷氧基磷酰基氨基酸酰胺。

  DOI：

  10.1055/s-1989-27149

文献信息

• HETEROAROMATIC COMPOUNDS HAVING SPHINGOSINE-1-PHOSPHATE (S1P) RECEPTOR AGONIST BIOLOGICAL ACTIVITY
  申请人：Beard Richard L.

  公开号：US20080064872A1

  公开（公告）日：2008-03-13

  A novel compound having agonist activity at the S 1 P 3 receptor which is represented by the formula I wherein X is selected from the group consisting of CR 3 , N and NO; Y is selected from the group consisting of CR 3 , N and NO; Z is selected from the group consisting of CR 3 , N and NO; and at least one of X, Y and Z is N or NO; V is O or NOR 4 R 1 is an aryl group; R 2 is an aryl group; R 3 is selected from the group consisting of H and alkyl; and 2 of said R 3 groups may together form a cyclic alkyl ring having from 3 to 6 carbon atoms; R 4 is selected from the group consisting of H and alkyl; a is 0 or an integer of from 1 to 6; b is 0 or 1; c is 0 or 1; f is 0 or an integer of 1 or 2; x is 0 or 1; y is 0 or an integer of from 1 to 3; and z is 0 or an integer of from 1 to 3.

  一种具有S1P3受体激动剂活性的新型化合物，其化学式为I，其中X选自CR3，N和NO组成的群体；Y选自CR3，N和NO组成的群体；Z选自CR3，N和NO组成的群体；并且X、Y和Z中至少有一个是N或NO；V是O或NOR4；R1是芳基基团；R2是芳基基团；R3选自H和烷基；其中2个R3基团可以共同形成具有3至6个碳原子的环烷基环；R4选自H和烷基；a为0或1至6的整数；b为0或1；c为0或1；f为0或1或2的整数；x为0或1；y为1至3的整数；z为0或1至3的整数。
• Heteroaromatic compounds having sphingosine-1-phosphate (S1P) receptor agonist biological activity
  申请人：Allergan, Inc.

  公开号：US07728014B2

  公开（公告）日：2010-06-01

  A novel compound having agonist activity at the S1P3 receptor which is represented by the formula I wherein X is selected from the group consisting of CR3, N and NO; Y is selected from the group consisting of CR3, N and NO; Z is selected from the group consisting of CR3, N and NO; and at least one of X, Y and Z is N or NO; V is O or NOR4 R1 is an aryl group; R2 is an aryl group; R3 is selected from the group consisting of H and alkyl; and 2 of said R3 groups may together form a cyclic alkyl ring having from 3 to 6 carbon atoms; R4 is selected from the group consisting of H and alkyl; a is 0 or an integer of from 1 to 6; b is 0 or 1; c is 0 or 1; f is 0 or an integer of 1 or 2; x is 0 or 1; y is 0 or an integer of from 1 to 3; and z is 0 or an integer of from 1 to 3.

  具有S1P3受体激动剂活性的新化合物，其由式I表示，其中： X从CR3，N和NO组成的群体中选择； Y从CR3，N和NO组成的群体中选择； Z从CR3，N和NO组成的群体中选择； 并且X，Y和Z中至少有一个是N或NO； V为O或NOR4； R1是芳基基团； R2是芳基基团； R3从H和烷基组成的群体中选择；其中2个R3基团可以共同形成具有3到6个碳原子的环烷基环； R4从H和烷基组成的群体中选择； a为0或1到6之间的整数； b为0或1； c为0或1； f为0或1或2之间的整数； x为0或1； y为1到3之间的整数； z为1到3之间的整数。
• Metal Ion-Dependent Interfacial Organization and Dynamics of Metal-Phosphonate Monolayers
  作者：Corbin Livingston、Gary J. Blanchard

  DOI：10.1021/acs.langmuir.1c00453

  日期：2021.4.20

  the ability to adjust the strength of interaction through metal ion identity. For such systems, both the exchange kinetics and thermodynamics of metal ion-complex formation contribute to the observed properties of the monolayer. We have synthesized metal-phosphate/phosphonate monolayers using Zr4+ and In3+ and have evaluated the metal ion dependence of monolayer dynamics for free and bound chromophores

  自组装单分子层由于其相对易于合成以及此类材料的广泛应用而被广泛研究。单层-支持物相互作用的强度范围可以从物理吸附到共价键形成，从而使单层的坚固性和流动性发生变化。由于能够通过金属离子同一性调节相互作用强度，因此通过金属离子络合的单层载体结合特别吸引人。对于这样的系统，金属离子配合物形成的交换动力学和热力学都有助于观察到的单层性能。我们已经使用Zr 4+和In 3+合成了金属磷酸盐/膦酸盐单层并评估了游离和结合发色团的单层动力学对金属离子的依赖性。我们的发现揭示了单层动力学和组织中重要的金属离子依赖性变化。
• Spatiotemporally Controlled Formation and Rotation of Magnetic Nanochains In Vivo for Precise Mechanotherapy of Tumors
  作者：Qinrui Fu、Hongjuan Feng、Luntao Liu、Ziqiao Li、Jianjie Li、Jing Hu、Chengzhi Hu、Xiaohui Yan、Huanghao Yang、Jibin Song

  DOI：10.1002/anie.202213319

  日期：2022.12.19

  A dual-mode imaging-guided cancer mechanotherapy was developed through in situ assembly and spinning of magnetic nanochains. This novel therapeutic modality could be suitable for precise yet effective cancer treatment in local regions.

  通过原位组装和旋转磁性纳米链，开发了一种双模式成像引导的癌症机械疗法。这种新颖的治疗方式可能适用于局部地区精确而有效的癌症治疗。
• Cameron, David G.; Hudson, Harry R.; Pianka, Max, Phosphorus, Sulfur and Silicon and the Related Elements, 1993, vol. 83, # 1-4, p. 21 - 38
  作者：Cameron, David G.、Hudson, Harry R.、Pianka, Max

  DOI：——

  日期：——