4-甲基环己烷甲酸苯酯 | 1711-34-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚酯
• 中文名称: 4-甲基环己烷甲酸苯酯
• 英文名称: 4-Methyl-cyclohexanecarboxylic acid phenyl ester
• 英文别名: Phenyl 4-methylcyclohexane-1-carboxylate
• CAS: 1711-34-8
• 化学式: C₁₄H₁₈O₂
• 分子量: 218.296
• InChiKey: RUDYNVVHAQTPQV-UHFFFAOYSA-N

物化性质

• 沸点：
  150-151.5 °C(Press: 8 Torr)
• 密度：
  1.041±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  16
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

安全信息

• 海关编码：
  2916209090

文献信息

• Cyclohexene derivative having alkenyl, liquid crystal composition and liquid crystal display device
  申请人：Shimada Teru

  公开号：US20080063814A1

  公开（公告）日：2008-03-13

  A liquid crystal compound selected from a group of compounds represented by formula (a): wherein Ra and Rb are each independently hydrogen, alkyl having 1 to 10 carbons or alkenyl having 2 to 10 carbons, provided that in the alkyl, —CH 2 — may be replaced by —O—, but plural —O— are not adjacent to each other, and hydrogen may be replaced by fluorine; ring A 1 and ring A 2 are each independently trans-1,4-cyclohexylene or 1,4-phenylene, provided that one or two hydrogens of the 1,4-phenylene may be replaced by halogen, and in a 6-membered ring of these groups, one —CH 2 — or two —CH 2 — that are not adjacent to each other may be replaced by —O—, and one or two —CH═ may be replaced by —N═; Z 1 and Z 2 are each independently a single bond, —(CH 2 ) 2 —, —(CH 2 ) 4 —, —CH═CH—, —C≡—, —CH 2 O—, —OCH 2 —, —COO—, —OCO— or —OCF 2 —; l and m are each independently 0, 1 or 2, provided that l+m is 0, 1, 2 or 3; and n is an integer of from 0 to 6, provided that in —(CH 2 ) n —, —CH 2 — may be replaced by —O—, but plural —O— are not adjacent to each other, and hydrogen may be replaced by fluorine.

  从由式（a）表示的化合物组中选择的液晶化合物： 其中Ra和Rb分别独立地是氢、具有1至10个碳的烷基或具有2至10个碳的烯基，前提是在烷基中，-CH2-可以被-O-替换，但多个-O-不相邻，氢可以被氟替换；环A1和环A2分别独立地是反-1,4-环己烯基或1,4-苯基，前提是1,4-苯基的一个或两个氢可以被卤素替换，在这些基团的6元环中，一个不相邻的-CH2-或两个不相邻的-CH2-可以被-O-替换，一个或两个-CH═可以被-N═替换；Z1和Z2分别独立地是单键，-(CH2)2-，-(CH2)4-，-CH═CH-，-C≡-，-CH2O-，-OCH2-，-COO-，-OCO-或-OCF2-；l和m分别独立地是0、1或2，前提是l+m为0、1、2或3；n是0至6的整数，前提是在-(CH2)n-中，-CH2-可以被-O-替换，但多个-O-不相邻，氢可以被氟替换。
• Chlorofluorobenzene liquid crystal compound, liquid crystal composition and liquid crystal display device
  申请人：Goto Yasuyuki

  公开号：US20080075891A1

  公开（公告）日：2008-03-27

  A liquid crystal compound selected from a group of compounds represented by formula (a): wherein Ra and Rb are each independently alkyl having 1 to 10 carbons, alkoxy having 1 to 9 carbons, alkoxyalkyl having 2 to 9 carbons, alkenyl having 2 to 10 carbons, alkenyloxy having 2 to 9 carbons, fluoroalkyl having 1 to 10 carbons or fluoroalkoxy having 1 to 9 carbons; ring A 1 , ring A 2 and ring A 3 are each independently trans-1,4-cyclohexylene, trans-1,3-dioxane-2,5-diyl, trans-tetrahydropyran-2,5-diyl, 1,4-phenylene, 2-fluoro-1,4-phenylene, 2,3-difluoro-1,4-phenylene, 2,5-difluoro-1,4-phenylene, 2,6-difluoro-1,4-phenylene, pyridine-2,5-diyl, 6-fluoropyridine-2,5-diyl or pyridazine-2,5-diyl; Z 1 , Z 2 and Z 3 are each independently a single bond, —(CH 2 ) 2 —, —CH═CH—, —C≡C—, —CH 2 O, —OCH 2 —, —COO—, —OCO—, —OCF 2 —, —CF 2 O—, —CH 2 CH 2 OCF 2 — or —CF 2 OCH 2 CH 2 —; l, m and n are each independently 0, 1 or 2, provided that l+m+n is 0, 1, 2 or 3; one of X 1 and X 2 is fluorine, and the other is chlorine; Q is and atoms comprising the compound each may be an isotope thereof.

  从由式（a）表示的化合物组中选择的液晶化合物： 其中Ra和Rb分别独立地是具有1至10个碳的烷基，具有1至9个碳的烷氧基，具有2至9个碳的烷氧基烷基，具有2至10个碳的烯基，具有2至9个碳的烯氧基，具有1至10个碳的氟烷基或具有1至9个碳的氟烷氧基；环A1，环A2和环A3分别独立地是反式-1,4-环己烷基，反式-1,3-二噁烷-2,5-二基，反式-四氢吡喃-2,5-二基，1,4-苯基，2-氟-1,4-苯基，2,3-二氟-1,4-苯基，2,5-二氟-1,4-苯基，2,6-二氟-1,4-苯基，吡啶-2,5-二基，6-氟吡啶-2,5-二基或吡啶并嗪-2,5-二基；Z1，Z2和Z3分别独立地是单键，—(CH2)—，—CH═CH—，—C≡C—，—CH2O，—OCH2—，—COO—，—OCO—，—OCF2—，—CF2O—，—CH2CH2OCF2—或—CF2OCH2CH2—；l，m和n分别独立地为0，1或2，前提是l+m+n为0，1，2或3；X1和X2中的一个是氟，另一个是氯；Q是 化合物中的原子均可是其同位素。
• FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE
  申请人：Kobayashi Masahide

  公开号：US20110090450A1

  公开（公告）日：2011-04-21

  The invention provides a liquid crystal compound which has stability to heat, light and so forth, a nematic phase in a wide temperature range, a small viscosity, a large optical anisotropy, and a suitable elastic constant K 33 , and further has a suitable and negative dielectric anisotropy and an excellent compatibility with other liquid crystal compounds. Moreover, the invention provides a liquid crystal composition comprising this liquid crystal compound and a liquid crystal display device containing this liquid crystal composition. A liquid crystal compound represented by formula (a): for example, R 1 and R 2 are alkyl having 1 to 10 carbons, alkenyl having 2 to 10 carbons or alkoxy having 1 to 9 carbons; ring A 1 and ring A 2 are 1,4-phenylene or trans-1,4-cyclohexylene; L 1 and L 2 are hydrogen or fluorine, and at least one of L 1 and L 2 is fluorine; and Z 1 and Z 2 are a single bond, —(CH 2 ) 2 —, —CH═CH—, —CH 2 O— or —OCH 2 —.

  本发明提供一种液晶化合物，具有耐热、耐光等稳定性，在广泛的温度范围内具有向列相，粘度小，光学各向异性大，适当的弹性常数K33，进一步具有适当且负的介电各向异性，与其他液晶化合物具有良好的相容性。此外，本发明还提供了包含该液晶化合物的液晶组合物和包含该液晶组合物的液晶显示装置。一种由公式（a）表示的液晶化合物：例如，R1和R2是具有1至10个碳原子的烷基，具有2至10个碳原子的烯基或具有1至9个碳原子的烷氧基；环A1和环A2是1,4-苯撑基或反-1,4-环己撑基；L1和L2是氢或氟，且至少有一个是氟；Z1和Z2是单键，-(CH2)2-，-CH═CH-，-CH2O-或-OCH2-。
• LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE
  申请人：Kobayashi Masahide

  公开号：US20120018672A1

  公开（公告）日：2012-01-26

  The invention provides a liquid crystal compound having a high stability to heat, light or the like, a wide temperature range of a nematic phase, a small viscosity, a large optical anisotropy and a suitable elastic constant K 33 , and further having a suitable negative dielectric anisotropy and an excellent compatibility with other liquid crystal compounds. The invention also provides a liquid crystal composition including this liquid crystal compound and a liquid crystal display device containing this liquid crystal composition. A liquid crystal compound represented by formula (a): For example, Ra and Rb are alkyl having 1 to 10 carbons, alkenyl having 2 to 10 carbons or alkoxy having 1 to 9 carbons; the ring A 1 and the ring A 2 are 1,4-phenylene or trans-1,4-cyclohexylene; L 1 , L 2 , L 3 and L 4 are hydrogen or fluorine, and at least three of them are fluorine; and Z 1 and Z 2 are a single bond, —(CH 2 ) 2 —, —CH═CH—, —CH 2 O— or —OCH 2 —.

  该发明提供了一种液晶化合物，具有高稳定性，能够抵抗热、光等因素的影响，具有广泛的向列相温度范围、小的粘度、大的光学各向异性和适当的弹性常数K33，进一步具有适当的负介电各向异性和与其他液晶化合物的良好兼容性。该发明还提供了一种包括该液晶化合物的液晶组合物和包含该液晶组合物的液晶显示器件。 液晶化合物由式（a）表示： 例如，Ra和Rb是具有1到10个碳原子的烷基，具有2到10个碳原子的烯基或具有1到9个碳原子的烷氧基；环A1和环A2是1,4-苯撑基或反-1,4-环己撑基；L1、L2、L3和L4是氢或氟，其中至少有三个是氟；Z1和Z2是单键，—(CH2)2—、—CH═CH—、—CH2O—或—OCH2—。
• THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE
  申请人：Kobayashi Masahide

  公开号：US20110037024A1

  公开（公告）日：2011-02-17

  The invention provides a liquid crystal compound represented by the following formula having stability to heat, light and so forth, a wide temperature range of a nematic phase, a small viscosity, a large optical anisotropy and a suitable elastic constant K 33 (K 33 : bend elastic constant), and further having a suitable and negative dielectric anisotropy and an excellent compatibility with other liquid crystal compounds, and provides a liquid crystal composition including the compound, wherein R 1 and R 2 are hydrogen, alkyl or the like, ring A 1 is trans-1,4-cyclohexylene, 1,4-phenylene or the like, L 1 to L 4 are hydrogen or fluorine, and at least three of them are fluorine; when the ring A 1 is trans-1,4-cyclohexylene or the like, Z 1 is a single bond, —(CH 2 ) 2 — or the like, when ring A 1 is 1,4-phenylene, Z 1 is —(CH 2 ) 2 — or the like.

  该发明提供了一种液晶化合物，其由以下公式表示，具有耐热、耐光等稳定性，具有向列相的宽温度范围、小粘度、大光学各向异性和适当的弹性常数K33（K33：弯曲弹性常数），并且具有适当的负电介质各向异性和与其他液晶化合物良好的相容性，并提供了包括该化合物的液晶组合物，其中R1和R2是氢、烷基或类似物，环A1是反式-1,4-环己基、1,4-苯基或类似物，L1到L4是氢或氟，其中至少三个是氟；当环A1为反式-1,4-环己基或类似物时，Z1是单键，-(CH2)2-或类似物，当环A1为1,4-苯基时，Z1是-(CH2)2-或类似物。