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1,2,3,4,5,6-hexahydrophthalic acid monoethylester | 67805-22-5

中文名称
——
中文别名
——
英文名称
1,2,3,4,5,6-hexahydrophthalic acid monoethylester
英文别名
Monoethyl cyclohexane-1,2-dicarboxylate;2-ethoxycarbonylcyclohexane-1-carboxylic acid
1,2,3,4,5,6-hexahydrophthalic acid monoethylester化学式
CAS
67805-22-5
化学式
C10H16O4
mdl
——
分子量
200.235
InChiKey
XGRJGTBLDJAHTL-UHFFFAOYSA-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

物化性质

  • 沸点:
    317.4±35.0 °C(Predicted)
  • 密度:
    1.158±0.06 g/cm3(Predicted)

计算性质

  • 辛醇/水分配系数(LogP):
    1.6
  • 重原子数:
    14
  • 可旋转键数:
    4
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.8
  • 拓扑面积:
    63.6
  • 氢给体数:
    1
  • 氢受体数:
    4

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    参考文献:
    名称:
    Hexahydrophthalic anilide derivatives
    摘要:
    本发明涉及新型的六氢酞酰苯胺衍生物和包含这些衍生物的除草剂组合物。本发明的六氢酞酰苯胺衍生物由公式[I]、[II]或[III]表示。其中,R1代表非取代或取代的苯基,R2代表氢或C1-C4烷基,R3代表C1-C4烷基或C1-C4烯基;R4和R5相同或不同,代表C1-C4烷基、C1-C4烯基或C1-C4炔基,但R4和R5不能同时为C1-C4烷基;X1和X2相同或不同,代表卤素,Y代表氧或硫,R6代表可被氧取代的C1-C6直链或环状烷基,R7代表氢或甲基,R8代表氰基、C1-C3烷基、C2或C3烯基、C2-C4炔基、C3-C6炔基,其被甲氧基取代,CONHR9(其中,R9代表芳香基磺酰基)或杂环咪唑环。
    公开号:
    US05068365A1
  • 作为产物:
    描述:
    Cyclohexane-1,2-dicarboxylic acid 1-ethyl ester 2-methyl ester 在 甲烷磺酸1-甲基咪唑氢溴酸盐,1-甲基溴化咪唑鎓 作用下, 反应 6.0h, 以85%的产率得到1,2,3,4,5,6-hexahydrophthalic acid monoethylester
    参考文献:
    名称:
    An Efficient Approach for the Deprotection of Esters Using Ionic Liquid as Nucleophile
    摘要:
    一种高效的酯去保护方法已被开发,使用离子液体作为亲核试剂,并在质子酸的存在下进行。以苯甲酸甲酯作为模型化合物,最佳结果是在120 ºC下反应2小时,使用1-甲基咪唑鎓溴和甲烷磺酸的组合,转化率达到96%。
    DOI:
    10.14233/ajchem.2013.14947
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文献信息

  • QUENCHER
    申请人:Wako Pure Chemical Industries, Ltd.
    公开号:US20170342031A1
    公开(公告)日:2017-11-30
    A quencher is disclosed having a compound represented by the following general formula (1): wherein R 5 each independently represent a halogen atom, an alkyl group, an alkoxy group, an alkylthio group, an amino group having a substituent or not having a substituent, a hydroxy group, an aryl group, an aryloxy group, or an arylalkyl group; R 6 represents a group having a polymerizable unsaturated group, a hydroxy group, or the like; Y 1 represents an oxygen atom, or the like; An − represents an anion; Ar 1 represents a specific ring structure; * and ** represent binding positions; Ar 2 represents a benzene ring, a naphthalene ring, or an anthracene ring; n 1 represents a specific integer; and the following structure (1-10) in the general formula (1) is an asymmetric structure; (wherein R 5 , Y 1 , Ar 1 , Ar 2 , n 1 , * and ** are the same as described above.).
    一种淬灭剂被公开,该淬灭剂具有以下一般公式(1)表示的化合物: 其中R5各自独立代表一个卤素原子、一个烷基团、一个烷氧基团、一个烷硫基团、一个带有或不带有取代基的氨基团、一个羟基、一个芳基团、一个芳氧基团或一个芳烷基团;R6代表一个具有可聚合不饱和基团、一个羟基或类似基团的集团;Y1代表一个氧原子或类似;An代表一个阴离子;Ar1代表一个特定的环结构;*和**代表结合位置;Ar2代表一个苯环、一个萘环或一个蒽环;n1代表一个特定的整数; 并且一般公式(1)中的以下结构(1-10)是一个不对称结构; (其中R5、Y1、Ar1、Ar2、n1、*和**与上述描述相同)。
  • Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester
    申请人:Kawahara Yasuyuki
    公开号:US20050038283A1
    公开(公告)日:2005-02-17
    A diester represented by the formula wherein A represents a cyclohexane ring, cyclohexene ring or benzene ring, X is H or methyl group, R X and R Y are the same or different and each is C3-C18 branched-chain alkyl group, C1-C18 straight-chain alkyl group, C2-C18 straight-chain alkenyl or C3-C18 cycloalkyl, provided that when A is a benzene ring, R X and R Y are different from each other and —COOR X and —COOR Y are attached to two adjacent carbon atoms of the benzene ring, and having the following properties: 1) a total acid number of 0.05 mgKOH/g or less, 2) a sulfated ash content of 10 ppm or less, 3) a sulfur content of 20 ppm or less, 4) a phosphorus content of 20 ppm or less, 5) a peroxide value of 1.0 meq/kg or less, 6) a carbonyl value of 10 or less; 7) a volume resistivity of 1×10 11 Ω·cm or more, 8) a hydroxyl value of 3 mgKOH/g or less, and 9) a water content of 100 ppm or less, a process for preparing the same and a refrigerator lubricating oil comprising the diester.
    由以下公式表示的二酯,其中A代表环己烷环、环己烯环或苯环,X为H或甲基基团,RX和RY相同或不同,且每个均为C3-C18支链烷基基团、C1-C18直链烷基基团、C2-C18直链烯基或C3-C18环烷基,前提是当A为苯环时,RX和RY彼此不同,且—COORX和—COORY连接到苯环的两个相邻碳原子,并具有以下特性:1)总酸值为0.05 mgKOH/g或更低,2)硫酸盐灰分含量为10 ppm或更低,3)硫含量为20 ppm或更低,4)磷含量为20 ppm或更低,5)过氧化值为1.0 meq/kg或更低,6)羰基值为10或更低;7)体积电阻率为1×1011Ω·cm或更高,8)羟值为3 mgKOH/g或更低,9)水含量为100 ppm或更低,制备该二酯的方法以及包含该二酯的制冷剂润滑油。
  • COLORED COMPOSITION
    申请人:WAKO PURE CHEMICAL INDUSTRIES, LTD.
    公开号:US20160040013A1
    公开(公告)日:2016-02-11
    The present invention is to provide a colored composition having higher heat resistance compared with conventional colored compositions. The present invention further relates to: “a polymer having a monomer unit derived from a monomer which has (i) a cationic rhodamine derivative having, as an counter anion, an anion including an aryl group having an electron-withdrawing substituent and an anion group and (ii) an ethylenically unsaturated bond”, “a monomer which has (i) a cationic rhodamine derivative having, as an counter anion, an anion including an aryl group having an electron-withdrawing substituent and an anion group and (ii) an ethylenically unsaturated bond”, “a colored composition comprising the above-described polymer or the monomer”, and “a colored composition for a color filter comprising the above-described polymer or the monomer”.
    本发明提供了一种具有比传统彩色组合更高耐热性的彩色组合。本发明还涉及:“具有源自具有(i)带有阴离子的阳离子罗丹明衍生物,所述阴离子包括具有电子吸引取代基的芳基和阴离子基团以及(ii)烯丙基不饱和键的单体单体单元的聚合物”,“具有(i)带有阴离子的阳离子罗丹明衍生物,所述阴离子包括具有电子吸引取代基的芳基和阴离子基团以及(ii)烯丙基不饱和键的单体单体单元的单体”,“包括上述聚合物或单体的彩色组合”,以及“用于彩色滤光片的彩色组合,包括上述聚合物或单体”。
  • SILICON-CONTAINING HETEROCYCLIC COMPOUND, AND QUENCHER
    申请人:FUJIFILM Wako Pure Chemical Corporation
    公开号:US20190233651A1
    公开(公告)日:2019-08-01
    Quenchers of the related art do not have a quenching ability high enough to sufficiently inhibit the emission of fluorescence from fluorescence compounds. Therefore, the present invention aims to provide a quencher which can sufficiently quench the fluorescence from fluorescent compounds including xanthene-based dyes. The present invention relates to a quencher formed of a compound represented by the following general formula (1), and the like. (In the formula, n 1 pieces of R 5 each independently represent a group having a polymerizable unsaturated group, an amino group having a substituent, or the like, R 6 represents a group having a polymerizable unsaturated group, a hydroxy group, or the like, An − represents an anion, Ar 1 represents a specific ring structure, * and ** each represent a position of bonding to the specific ring structure, Ar 2 represents a benzene ring or the like, in a case where Ar 2 is the benzene ring, n 1 represents an integer of 0 to 4, and R 32 and R 33 each independently represent an alkyl group or an aryl group.)
    相关艺术中的淬火剂没有足够高的淬火能力,以充分抑制荧光化合物的荧光发射。因此,本发明旨在提供一种可以充分淬火包括黄酮基染料在内的荧光化合物的荧光的淬火剂。本发明涉及由以下一般式(1)所代表的化合物形成的淬火剂等。(在该式中,n1个R5分别独立地表示具有聚合不饱和基团、具有取代基的氨基团等的基团,R6表示具有聚合不饱和基团、羟基等的基团,An−表示一个阴离子,Ar1表示特定的环结构,*和**分别表示与特定环结构结合的位置,Ar2表示苯环或类似物,在Ar2为苯环的情况下,n1表示0到4的整数,R32和R33分别独立地表示烷基或芳基。)
  • RHODAMINE-BASED COLORING COMPOSITION
    申请人:WAKO PURE CHEMICAL INDUSTRIES, LTD.
    公开号:US20170145216A1
    公开(公告)日:2017-05-25
    A colored resin composition using a conventional rhodamine derivative has not provided heat resistance in a practical range. Therefore, it is an object of the present invention to provide a coloring composition having higher heat resistance as compared with the conventional coloring composition. The present invention relates to a compound represented by the following general formula (1), and a polymer having a monomer unit derived from the compound, and the like. (wherein R 1 to R 4 each independently represent a hydrogen atom, an alkyl group, and the like; R 7 represents a hydrogen atom or a methyl group; R 8 and R 9 each independently represent a hydrogen atom or an alkyl group; Y represents a nitrogen atom or a group represented by the following formula (1-1): A 1 represents an alkylene group which has at least one group selected from —O—, —OCO—, —COO—, —NHCO—, —CONH—, —NHCONH— and an arylene group in the chain, and the like; A 2 represents —NH— or —O—; An − represents an anion containing an aryl group having an electron-withdrawing substituent, and the like; n represents an integer of 0 to 3; R 8 and R 9 may form a cyclic structure of a 5 to 6 membered ring together with —N—(CH 2 ) n —Y— bonding thereto.)
    使用传统的罗丹明衍生物的有色树脂组合物在实际范围内未提供耐热性。因此,本发明的目的是提供一种比传统着色组合物具有更高耐热性的着色组合物。本发明涉及由以下通式(1)所代表的化合物,以及具有源自该化合物的单体单位的聚合物等。(其中R1至R4分别独立地代表氢原子、烷基基团等;R7代表氢原子或甲基基团;R8和R9分别独立地代表氢原子或烷基基团;Y代表氮原子或由以下式(1-1)所代表的基团:A1代表在链中至少具有一种从—O—,—OCO—,—COO—,—NHCO—,—CONH—,—NHCONH—和芳基基团中选择的基团的亚烷基基团等;A2代表—NH—或—O—;An−代表含有具有电子吸引取代基的芳基团的阴离子等;n表示0至3的整数;R8和R9可以与结合其的—N—(CH2)n—Y—共同形成5至6元环的环状结构。)
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