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(S)-2,2,4-Trimethyl-[1,3]dioxolane | 116944-24-2

中文名称
——
中文别名
——
英文名称
(S)-2,2,4-Trimethyl-[1,3]dioxolane
英文别名
(4S)-2,2,4-trimethyl-1,3-dioxolane
(S)-2,2,4-Trimethyl-[1,3]dioxolane化学式
CAS
116944-24-2
化学式
C6H12O2
mdl
——
分子量
116.16
InChiKey
ALTFLAPROMVXNX-YFKPBYRVSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    0.9
  • 重原子数:
    8
  • 可旋转键数:
    0
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    1.0
  • 拓扑面积:
    18.5
  • 氢给体数:
    0
  • 氢受体数:
    2

反应信息

  • 作为产物:
    描述:
    (S)-(+)-1,2-丙二醇2,2-二甲氧基丙烷 在 camphor-10-sulfonic acid 作用下, 生成 (S)-2,2,4-Trimethyl-[1,3]dioxolane
    参考文献:
    名称:
    BINOL-Salen-Co(III)盐的新型手性聚合物对二氧化碳和环氧丙烷的催化不对称环加成反应
    摘要:
    Abstractmagnified imageFour new chiral polymers of BINOL‐Salen‐cobalt(III) salt complexes have been designed, synthesized and applied to the direct fabrication of chiral propylene carbonate from racemic propylene oxide. The (R/S)‐polymer catalyst 2 and (S/R)‐polymer catalyst 4 exhibit better enantioselectivity than the (R/R)‐polymer catalyst 1 and the (S/S)‐polymer catalyst 3 and have been recovered and reused more than ten times without loss of activity and enantioselectivity.
    DOI:
    10.1002/adsc.200900137
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文献信息

  • [EN] PRODRUG BIPYRIDYLAMINOPYRIDINES AS SYK INHIBITORS<br/>[FR] PROMÉDICAMENT BIPYRIDYLAMINOPYRIDINES EN TANT QU'INHIBITEURS DE SYK
    申请人:MERCK SHARP & DOHME
    公开号:WO2014074421A1
    公开(公告)日:2014-05-15
    The present invention provides compounds of Formula (I), which are prodrugs of trans-4-[(1R)-(6-[4-(difluoromethyl)pyridin-2-yl]amino}-4-methyl-2,3'-bipyridin-6'-yl)-1-hydroxyethyl]cyclohexanecarboxylic acid, a potent inhibitor of Syk. The compounds are useful in the treatment and prevention of diseases mediated by the enzyme, such as asthma, COPD, rheumatoid arthritis and cancer.
    本发明提供了化合物的公式(I),这些化合物是trans-4-[(1R)-(6-[4-(二氟甲基)吡啶-2-基]氨基}-4-甲基-2,3'-联吡啶-6'-基)-1-羟乙基]环己烷羧酸的前药,是Syk的有效抑制剂。这些化合物在治疗和预防由该酶介导的疾病方面非常有用,如哮喘、慢性阻塞性肺病、类风湿性关节炎和癌症。
  • [EN] AROMATASE INHIBITOR<br/>[FR] INHIBITEUR D'AROMATASE
    申请人:STERIX LTD
    公开号:WO2011023989A1
    公开(公告)日:2011-03-03
    There is provided a compound of formula (I) wherein Z is selected from N and CR22, wherein R22 is H or a bond with D, wherein D is selected from a bond, C=O, and linear or branched hydrocarbon groups having a carbon chain of from 1 to 6 carbon atoms, wherein the carbon chain optionally contains an oxy group (=0), an ether (-0-) or thioether (-S-) link, wherein R1 is selected from :triazolyl, imidazolyl, pyrimidinyl radical wherein each of R2 to R6 is independently selected from -H, NO2, halo, -CN, -N[(C=O)0-1R12][(C=O)0-1R13] and -(CH2)0-1R14, or two adjacent groups of R2 to R6, together with the carbon atoms to which they are attached, form a ring, wherein at least one of R2 to R6 is -CN, wherein (i) at least one of R2 to R6 is -(CH2)0-1R14, or (ii) at least one of R2 to R6 is -N[(C=O)0-1, R12][(C=O)0-1R13], or (iii) at least two adjacent groups of R2 to R6 together with the carbon atoms to which they are attached, form a ring, or (iv) at least one of R2 to R6 is -(CH2)0-1O-R'14, wherein R12 and R13 are independently selected from H, linear or branched hydrocarbon groups having a carbon chain of from 1 to 10 carbon atoms, or together with the atoms to which they are attached, may form a mono or bicyclic ring having from 5 to14 ring members wherein R14 is selected from: aliphatic ring systems; unsubstituted or substituted monocyclic aliphatic heterocycles; unsubstituted or substituted heteroaryl radical, and unsubstituted or substituted phenyl group; the group of formula (a) wherein t is 1 or 2, wherein R'14 is a unsubstituted or substituted phenyl group, wherein each of R7 to R11 is independently selected from -H, NO2, halo, -O-(C1-C6)haloalkyl, (C1-C6)haloalkyl, (C1-C6)alkyl, -CN, -OH, -OPh, -OBn, -Ph, -OSO2NR15R16, -SO2R26, -SO2NR27NR28, -O-(C1C6)alkyl, -(C=O)0-1NR29R30 and -CO(O)0-1R31; wherein R15 and R16 are independently selected from H, alkyl, cycloalkyl, alkenyl, acyl and aryl, or combinations thereof, or together represent alkylene, wherein the or each alkyl or cycloalkyl or alkenyi optionally contain one or more hetero atoms or groups wherein each of R26 to R31 is independently selected from H, alkyl, cycloalkyl, alkenyl, acyl and aryl, or combinations thereof, or together represent alkylene, wherein the or each alkyi or cycloalky! or alkenyl optionally contain one or more hetero atoms or groups, or any pharmaceutically acceptable salts thereof.
    提供了一个式(I)的化合物,其中Z从N和CR22中选择,其中R22是H或与D形成键,其中D从键,C=O和线性或支链碳链为1至6个碳原子的烃基中选择,其中碳链可选地含有氧基(=0),醚(-0-)或硫醚(-S-)键,其中R1从:三唑基,咪唑基,嘧啶基中选择,其中R2到R6中的每个独立地从-H,NO2,卤素,-CN,-N[(C=O)0-1R12][(C=O)0-1R13]和-(CH2)0-1R14中选择,或者R2到R6中的两个相邻基团,与它们连接的碳原子一起形成一个环,其中R2到R6中至少有一个是-CN,其中(i)R2到R6中至少有一个是-(CH2)0-1R14,或者(ii)R2到R6中至少有一个是-N[(C=O)0-1, R12][(C=O)0-1R13],或者(iii)R2到R6中至少有两个相邻基团,与它们连接的碳原子一起形成一个环,或者(iv)R2到R6中至少有一个是-(CH2)0-1O-R'14,其中R12和R13独立地从H,线性或支链碳链为1至10个碳原子的烃基中选择,或者与它们连接的原子一起,可以形成具有5至14个环成员的单环或双环环,其中R14从中选择:脂环系统;未取代或取代的单环脂杂环;未取代或取代的杂芳基,和未取代或取代的苯基;式(a)的基团,其中t为1或2,其中R'14是未取代或取代的苯基,其中R7到R11中的每个独立地从-H,NO2,卤素,-O-(C1-C6)卤代烷基,(C1-C6)卤代烷基,(C1-C6)烷基,-CN,-OH,-OPh,-OBn,-Ph,-OSO2NR15R16,-SO2R26,-SO2NR27NR28,-O-(C1C6)烷基,-(C=O)0-1NR29R30和-CO(O)0-1R31中选择;其中R15和R16独立地从H,烷基,环烷基,烯基,酰基和芳基中选择,或者它们的组合,或者一起代表烷基,其中每个R26到R31独立地从H,烷基,环烷基,烯基,酰基和芳基中选择,或者它们的组合,或者一起代表烷基,其中每个烷基或环烷基或烯基可选地含有一个或多个杂原子或基团,或其任何药学上可接受的盐。
  • 2-PHENYL-6-AMINOCARBONYL-PYRIMIDINE DERIVATIVES AND THEIR USE AS P2Y12 RECEPTOR
    申请人:Caroff Eva
    公开号:US20090291962A1
    公开(公告)日:2009-11-26
    The invention relates to 2-phenyl-6-aminbcarbonyl-pyrimidinc derivatives and their use as P2Y 12 receptor antagonists in the treatment and/or prevention and/or treatment of peripheral vascular, of visceral-, hepatic- and renal-vascular, of cardiovascular and of cerebrovascular diseases or conditions associated with platelet aggregation, including thrombosis in humans and other mammals. Formula (1).
    这项发明涉及2-苯基-6-氨基羰基嘧啶衍生物及其作为P2Y12受体拮抗剂在治疗和/或预防和/或治疗外周血管、内脏-、肝脏和肾脏血管、心血管和脑血管疾病或与血小板聚集有关的疾病或病况的用途,包括人类和其他哺乳动物中的血栓形成。公式(1)。
  • Analytical enantiomer separation of aliphatic diols as boronates and acetals by complexation gas chromatography
    作者:V. Schurig、D. Wistuba
    DOI:10.1016/s0040-4039(01)91399-1
    日期:1984.1
    Cyclic boronates and acetals of mono- and dialkylsubstituted 1,2-, 2,3- 1,3- & 1,4- diols have been quantitatively separated into enantiomers by complexation gas chromatography utilizing optically active metal chelates. An efficient, precise & sensitive method for determining enantiomeric purities for volatile glycols is thus available.
    单和二烷基取代的1,2-,2,3-,1,3-和1,4-二醇的环状硼酸酯和缩醛已通过利用光学活性金属螯合物的络合气相色谱法定量分离为对映体。因此,可以使用一种有效,精确和灵敏的方法来测定挥发性二醇的对映体纯度。
  • [EN] PREPARATION OF (R)- AND (S)-N-(3, 4-DIFLUORO-2-(2-FLUORO-4-IODOPHENYLAMINO)--6-METHOXYPHENYL) -1- (2, 3-DIHYDROXYPROPYL)CYCLOPROPANE-1-SULFONAMIDE AND PROTECTED DERIVATIVES THEREOF<br/>[FR] PRÉPARATION DE (R)- ET (S)-N-(3,4-DIFLUORO-2-(2-FLUORO—4-IODOPHÉNYLAMINO)-6-MÉTHOXYPHÉNYL)-1- (2,3-DIHYDROXYPROPYL)CYCLOPROPANE-1-SULFONAMIDE ET DE LEURS DÉRIVÉS PROTÉGÉS
    申请人:ARDEA BIOSCIENCES INC
    公开号:WO2011009541A1
    公开(公告)日:2011-01-27
    The present invention relates to the preparation of (R)-N-(3,4-difluoro-2-(2-fluoro-4-iodophenylamino)-6-methoxyphenyl)-1-(2,3-dihydroxypropyl)cyclopropane-1-sulfonamide and (S)-N-(3,4-difluoro-2-(2-fluoro-4-iodophenylamino)-6-methoxyphenyl)-1-(2,3-dihydroxypropyl)cyclopropane-1-sulfonamide. (I)
    该发明涉及(R)-N-(3,4-二氟-2-(2-氟-4-碘苯胺基)-6-甲氧基苯基)-1-(2,3-二羟基丙基)环丙烷-1-磺酰胺和(S)-N-(3,4-二氟-2-(2-氟-4-碘苯胺基)-6-甲氧基苯基)-1-(2,3-二羟基丙基)环丙烷-1-磺酰胺的制备。(I)
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