2-氨基-2-苯基-1,3-丙烷二醇 | 5428-03-5

• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: 2-氨基-2-苯基-1,3-丙烷二醇
• 英文名称: 2-amino-2-phenyl-propane-1,3-diol
• 英文别名: 2-Amino-2-phenyl-propan-1,3-diol；2-Phenyl-2-amino-1,3-propandiol；2-Amino-2-phenylpropane-1,3-diol
• CAS: 5428-03-5
• 化学式: C₉H₁₃NO₂
• mdl: MFCD07779503
• 分子量: 167.208
• InChiKey: WVSJVXCMZDSAHS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.7
• 重原子数：
  12
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.333
• 拓扑面积：
  66.5
• 氢给体数：
  3
• 氢受体数：
  3

安全信息

• 海关编码：
  2922199090

反应信息

• 作为反应物：
  描述：

  二氯乙酸甲酯 、 2-氨基-2-苯基-1,3-丙烷二醇 生成 dichloro-acetic acid-(2-hydroxy-1-hydroxymethyl-1-phenyl-ethylamide)
  参考文献：
  名称：

  15.氯霉素的某些类似物

  摘要：

  DOI：

  10.1039/jr9520000063
• 作为产物：
  描述：

  2-硝基-2-苯丙烷-1,3-二醇 在 乙醇 、 镍 作用下， 生成 2-氨基-2-苯基-1,3-丙烷二醇
  参考文献：
  名称：

  15.氯霉素的某些类似物

  摘要：

  DOI：

  10.1039/jr9520000063

文献信息

• METHOD OF PREPARING DENDRONS AND DENDRIMERS WITH HETEROCYCLIC SUBSTRUCTURES OF IMINO-ETHERS AND DERIVATIVES USING NON-STANDARD MEANS AND MICROWAVES
  申请人：Centro Nacional De Investigaciones Cientificas (CNIC)

  公开号：EP1566399A1

  公开（公告）日：2005-08-24

  Dendrons and dendrimers are prepared by synthetic procedures under microwaves starting from heterocyclic substructures of C2 and C4 substituted iminoethers or from their boronic, sulfonic and phosphoric derivatives, or from their N-substituted derivatives, cyclic and acyclics, their products of hydrolysis or the transformations of them in other pentagonal nitrogenated heterocycles with incorporation in some cases, of structural units of chromogenic or fluorogenic glucuronides in their cavities or in the dendrimeric surface, in dependence of the functionality of the outlying groups. Starting from different reactions of the iminoetheres with carboxylic acids, anhydrides, esters, bases, aldehydes, alkyl halides, amines, isocyanates, aromatic thiols, by pyrolysis or hydrolysis, in sequences of selected reactions, alternated and iteratives, with the use of procedures and non classic methods of synthesis under microwaves at power between 30 and 300 Watt at 2450 MHz, to achieve the formation of basic substructures for the construction of dendrons, arms or ramifications of dendritic structures of different generations, from G0 to G4, by a convergent strategy, in presence or absence of solvents and/or polymeric or mineral solid supports.

  树枝状分子和树枝状聚合物是在微波条件下通过合成程序制备的，其起始原料是 C2 和 C4 取代的亚氨基乙烷杂环子结构，或其硼酸、磺酸和磷酸衍生物，或其 N 取代衍生物、环状和非环状衍生物、它们的水解产物，或它们在其他五角含氮杂环中的转化产物，在某些情况下，它们的空腔或树枝状表面会根据外层基团的功能性加入致色或致氟葡萄糖醛酸的结构单元。 从亚胺醚与羧酸、酸酐、酯、碱、醛、烷基卤化物、胺、异氰酸酯、芳香族硫醇的不同反应开始，通过热解或水解，在选定的反应序列中，交替和迭代，在功率介于 30 瓦到 300 瓦、频率为 2450 兆赫的微波下，使用程序和非传统的合成方法、在有或没有溶剂和/或聚合物或矿物固体支持物的情况下，通过聚合策略，形成基本的亚结构，用于构建从 G0 到 G4 不同世代的树枝状结构的树枝、树枝臂或树枝分支。
• NITRATED HYDROCARBONS AND DERIVATIVES
  申请人：ANGUS CHEMICAL COMPANY

  公开号：EP3121162A1

  公开（公告）日：2017-01-25

  A compound selected from the group consisting of formula I-1, II-1, III-1 and IV-1: or a compound selected from the group consisting of: 2-(hydroxylamino)hexane, 3-(hydroxylamino)hexane, 2-(hydroxylamino)octane, and 3-(hydroxylamino)octane, wherein: R7 and R9 are independently linear C2-C17 alkyl; R11 is an unsubstituted linear C2-C17 alkyl; R8 is H or linear C1-C8 alkyl; R10 and R14 are independently H, linear C1-C8 alkyl, or CH2OH, or R9, R10, and the carbon to which they are attached form an eight membered cycloalkyl ring; R12 is H, an unsubstituted linear C1-C8 alkyl, or CH2OH, or R11, R12, and the carbon to which they are attached form a C9-C11 cycloalkyl ring; R13 is C2-C20 alkyl, C3-C12 cycloalkyl, aryl, or aryl-alkyl-; R14 is H or C1-C12 alkyl, or R13 and R14 together with the carbon to which they are attached form a C3-C12 cycloalkyl ring; R15 is H, or R14, R15, and the atoms to which they are attached form an oxazolidine ring that is optionally substituted with C1-C6 alkyl; and R16 is H, C1-C12 alkyl, C3-C12 cycloalkyl, or aryl; provided that: when the compound is selected from formula I-1, the total number of carbons in R7 and R8, together with the carbon to which they are attached, is 10 to 18; and the compound is not 1-nitrodecane, 2-nitrodecane, 1-nitroundecane, 2-nitroundecane, 3-nitroundecane, 4-nitroundecane, 5-nitroundecane, 6-nitroundecane, 1-nitrododecane, 2-nitrododecane, 3-nitrododecane, 4-nitrododecane, 5-nitrododecane, 6-nitrododecane, 1-nitrotridecane, 2-nitrotridecane, 3-nitrotridecane, 6-nitrotridecane, 1-nitrotetradecane, 1-nitropentadecane, 1-nitrohexadecane, 2-nitrohexadecane, 1-nitroheptadecane, 1-nitrooctadecane, or 2-nitrooctadecane; when the compound is selected from formula II-1, if R10 is H or linear C1-C8 alkyl, the total number of carbons in R9 and R10, together with the carbon to which they are attached, is 5 to 18; or if R10 is CH2OH, R9 is linear C12-C16 alkyl; and the compound is not 2-nitro-1-hexanol, 2-nitro-1-heptanol, 2-nitro-1-octanol, 2-methyl-2-nitro-1-heptanol, or 2-nitro-1-dodecanol; when the compound is selected from formula III-1, if R12 is H or linear C1-C8 alkyl, the total number of carbons in R11 and R12, together with the carbon to which they are attached, is 6 to 18; or if R12 is CH2OH, R11 is linear C7-C17 alkyl; and the compound is not 2-amino-1-heptanol, 2-amino-2-methyl-1-hexanol, 2-amino-1-octanol, 2-amino-2-ethyl-1-hexanol, 2-amino-1-nonanol, 2-amino-2-methyl-1-octanol, 2-amino-1-decanol, 2-amino-2-octyl-1,3-propanediol, 2-amino-2-butyl-1-hexanol, 2-amino-1-undecanol, 2-amino-1-dodecanol, 2-amino-2-decyl-1,3-propanediol, 2-amino-1-tridecanol, 2-amino-2-methyl-1-dodecanol, 2-amino-1-tetradecanol, 2-amino-2-dodecyl-1,3-propanediol, 2-amino-2-methyl-1-tridecanol, 2-amino-1-pentadecanol, 2-amino-2-tridecyl-1,3-propanediol, 2-amino-1-hexadecanol, 2-amino-2-tetradecyl-1,3-propanediol, 2-amino-2-methyl-1-pentadecanol, 2-amino-2-hexyl-1-decanol, 2-amino-1-heptadecanol, 2-amino-2-pentadecyl-1,3-propanediol, 2-amino-1-octadecanol, or 2-amino-2-hexadecyl-1,3-propanediol; and when the compound is selected from formula IV-1, if R13 is an ethyl group, R14 is not H; and the compound is not 5-propyl-1-aza-3,7-dioxabicyclo[3.3.0]octane, 4,4-diethyl-1-oxa-3-azacyclopentane, 3-oxa-1-azaspiro[4.4]nonane, 3-oxa-1-azaspiro[4.5]decane, or 3-oxa-1-azaspiro[4.7]dodecane.

  从式 I-1、II-1、III-1 和 IV-1 所组成的组中选出的化合物： 或选自以下组别的化合物2-(羟基氨基)己烷、3-(羟基氨基)己烷、2-(羟基氨基)辛烷和 3-(羟基氨基)辛烷，其中：R7 和 R9 独立地是线性 C2-C17 烷基；R11 是未取代的线性 C2-C17 烷基；R8 是 H 或线性 C1-C8 烷基；R10 和 R14 独立地是 H、线性 C1-C8 烷基或 CH2OH，或 R9、R10 和它们所连接的碳形成八位环烷基环；R12 是 H、未取代的线性 C1-C8 烷基或 CH2OH，或 R11、R12 和它们所连接的碳形成 C9-C11 环烷基环；R13 是 C2-C20 烷基、C3-C12 环烷基、芳基或芳基烷基；R14 是 H 或 C1-C12 烷基，或 R13 和 R14 与它们连接的碳一起形成 C3-C12 环烷基环；R15 是 H，或 R14、R15 和它们连接的原子形成任选被 C1-C6 烷基取代的噁唑烷环；以及 R16 是 H、C1-C12 烷基、C3-C12 环烷基或芳基； 条件是当化合物选自式 I-1 时，R7 和 R8 中的碳原子总数连同它们所连接的碳原子数为 10 至 18；且该化合物不是 1-硝基十二烷、2-硝基十二烷、1-硝基十四烷、2-硝基十四烷、3-硝基十四烷、4-硝基十四烷、5-硝基十四烷、6-硝基十四烷、1-硝基十二烷、2-硝基十二烷、3-硝基十二烷、4-硝基十二烷、5-硝基十二烷6-硝基十二烷、1-硝基十三烷、2-硝基十三烷、3-硝基十三烷、6-硝基十三烷、1-硝基十四烷、1-硝基十五烷、1-硝基十六烷、2-硝基十六烷、1-硝基十七烷、1-硝基十八烷或 2-硝基十八烷；当化合物选自式 II-1 时，如果 R10 是 H 或直链 C1-C8 烷基，则 R9 和 R10 中的碳原子总数连同它们所连接的碳原子数为 5 至 18；或者如果 R10 是 CH2OH，则 R9 是直链 C12-C16 烷基；并且化合物不是 2-硝基-1-己醇、2-硝基-1-庚醇、2-硝基-1-辛醇、2-甲基-2-硝基-1-庚醇或 2-硝基-1-十二烷醇；当化合物选自式 III-1，如果 R12 是 H 或线型 C1-C8 烷基，则 R11 和 R12 中的碳原子总数连同它们所连接的碳原子数为 6 至 18；或者如果 R12 是 CH2OH，则 R11 是线型 C7-C17 烷基；且化合物不是 2-氨基-1-庚醇、2-氨基-2-甲基-1-己醇、2-氨基-1-辛醇、2-氨基-2-乙基-1-己醇、2-氨基-1-壬醇、2-氨基-2-甲基-1-辛醇、2-氨基-1-癸醇、2-氨基-2-辛基-1、3-丙二醇、2-氨基-2-丁基-1-己醇、2-氨基-1-十一醇、2-氨基-1-十二醇、2-氨基-2-癸基-1,3-丙二醇、2-氨基-1-十三醇、2-氨基-2-甲基-1-十二醇、2-氨基-1-十四醇、2-amino-2-dodecyl-1,3-propanediol, 2-amino-2-methyl-1-tridecanol, 2-amino-1-pentadecanol, 2-amino-2-tridecyl-1,3-propanediol, 2-amino-1-hexadecanol, 2-amino-2-tetradecyl-1,3-propanediol、2-amino-2-methyl-1-pentadecanol, 2-amino-2-hexyl-1-decanol, 2-amino-1-heptadecanol, 2-amino-2-pentadecyl-1,3-propanediol, 2-amino-1-octadecanol, 或 2-amino-2-hexadecyl-1,3-propanediol；当化合物选自式 IV-1 时，如果 R13 是乙基，R14 不是 H；且化合物不是 5-丙基-1-氮杂-3,7-二氧杂环[3.3.0]辛烷、4,4-二乙基-1-氧杂-3-氮杂环戊烷、3-氧杂-1-氮杂螺[4.4]壬烷、3-氧杂-1-氮杂螺[4.5]癸烷或 3-氧杂-1-氮杂螺[4.7]十二烷。
• Method of preparing dendrons and dendrimers with heterocyclic substructures of imino-ethers and derivatives using non-standard means and microwaves
  申请人：Marrero Terrero Leilani Alma

  公开号：US20060131160A1

  公开（公告）日：2006-06-22

  Dendrons and dendrimers are prepared by synthetic procedures under microwaves starting from heterocyclic substructures of C2 and C4 substituted iminoethers or from their boronic, sulfonic and phosphoric derivatives, or from their N-substituted derivatives, cyclic and acyclics, their products of hydrolysis or the transformations of them in other pentagonal nitrogenated heterocycles with incorporation in some cases, of structural units of chromogenic or fluorogenic glucuronides in their cavities or in the dendrimeric surface, in dependence of the functionality of the outlying groups. Starting from different reactions of the iminoetheres with carboxylic acids, anhydrides, esters, bases, aldehydes, alkyl halides, amines, isocyanates, aromatic thiols, by pyrolysis or hydrolysis, in sequences of selected reactions, alternated and iteratives, with the use of procedures and non classic methods of synthesis under microwaves at power between 30 and 300 Watt at 2450 MHz, to achieve the formation of basic substructures for the construction of dendrons, arms or ramifications of dendritic structures of different generations, from G0 to G4, by a convergent strategy, in presence or absence of solvents and/or polymeric or mineral solid supports.

  树枝状分子和树枝状聚合物是在微波条件下通过合成程序制备的，其起始原料是 C2 和 C4 取代的亚氨基乙烷杂环子结构，或其硼酸、磺酸和磷酸衍生物，或其 N 取代衍生物、环状和非环状衍生物、它们的水解产物，或它们在其他五角含氮杂环中的转化产物，在某些情况下，它们的空腔或树枝状表面会根据外层基团的功能性加入致色或致氟葡萄糖醛酸的结构单元。从亚胺醚与羧酸、酸酐、酯、碱、醛、烷基卤化物、胺、异氰酸酯、芳香族硫醇的不同反应开始，通过热解或水解，在选定的反应序列中，交替和迭代，在功率介于 30 瓦到 300 瓦、频率为 2450 兆赫的微波下，使用程序和非传统的合成方法、在有或没有溶剂和/或聚合物或矿物固体支持物的情况下，通过聚合策略，形成基本的亚结构，用于构建从 G0 到 G4 不同世代的树枝状结构的树枝、树枝臂或树枝分支。
• Broadbent,H.S. et al., Journal of Heterocyclic Chemistry, 1976, vol. 13, p. 337 - 348
  作者：Broadbent,H.S. et al.

  DOI：——

  日期：——
• Synthesis of 2-Dichloroacetamido-2-p-nitrophenyl-1,3-propanediol, a Position Isomer of Chloramphenicol
  作者：P. M. Ruoff、J. Robert Miller

  DOI：10.1021/ja01159a522

  日期：1950.3