5-Butyl-3-methylcyclohex-2-en-1-ol

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 5-Butyl-3-methylcyclohex-2-en-1-ol
• 英文别名: 5-butyl-3-methylcyclohex-2-en-1-ol
• 化学式: C₁₁H₂₀O
• 分子量: 168.28
• InChiKey: HJJKSRLYMHUSJE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  12
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.82
• 拓扑面积：
  20.2
• 氢给体数：
  1
• 氢受体数：
  1

文献信息

• CONTROL AND REPELLENCY OF BED BUGS
  申请人：Bedoukian Research, Inc.

  公开号：EP3257376A1

  公开（公告）日：2017-12-20

  Control or repellency of bed bugs is accomplished by bringing the bed bugs into contact with at least one of the compounds of the structure (I) Wherein R is selected from -OH, -OC(O)R4, -OR6, -(OR6)2, wherein each R6 is independently selected from an alkyl group containing from 1 to 4 carbon atoms and R4 is a branched or straight chain saturated or unsaturated hydrocarbyl group with zero to two double bonds and from 1 to 15 carbon atoms; X is O or CH2, with the proviso that when X is O R can only be =O; each Z is independently selected from (CH) and (CH2) y is a numeral selected from 1 and 2; R1 is selected from H or a branched or straight chain saturated or unsaturated hydrocarbyl group with zero to two double bonds and from 1 to 15 carbon atoms. R2 is selected from H and a branched or straight chain saturated or unsaturated hydrocarbyl group with zero to three double bonds and from 1 to 15 carbon atoms. R3 is selected from H, a branched or straight chain, saturated or unsaturated hydrocarbyl group with zero to three double bonds and from 1 to 15 carbon atoms, -(CH2)nOH, -C(O)OR5, -CH2C(O)OR7,-CH2C(O)R8, -C(O)NR9R10, -CH2C(O)NR11R12 where each of R5, R7, R8, R9, R10, R11 and R12 is independently selected from H and a branched or straight chain, saturated or unsaturated hydrocarbyl group with zero to three double bonds and from 1 to 15 carbon atoms, and n is an integer of from 1 to 12; and the bond between the 2 and 3 positions in the ring structure may be a single or a double bond, and wherein the compounds of structure (1) contain from 11 to 20 total carbon atoms, except where R is =O, X = CH2 and y is 1 the compounds of structure (I) contain from 13 to 20 total carbon atoms in the compounds. wherein the compounds of structure (1) contain from 11 to 20 total carbon atoms, except where R is =O, X = CH2 and y is 1 the compounds of structure (I) contain from 13 to 20 total carbon atoms in the compounds. wherein the compounds of structure (1) contain from 11 to 20 total carbon atoms, except where R is =O, X = CH2 and y is 1 the compounds of structure (I) contain from 13 to 20 total carbon atoms in the compounds.

  通过使臭虫与至少一种结构(I)的化合物接触，达到控制或驱除臭虫的目的 其中 R 选自-OH、-OC(O)R4、-OR6、-(OR6)2，其中每个 R6 独立地选自含有 1 至 4 个碳原子的烷基，R4 是具有 0 至 2 个双键和 1 至 15 个碳原子的支链或直链饱和或不饱和烃基； X 是 O 或 CH2，但当 X 是 O 时，R 只能是 =O； 每个 Z 独立选自 (CH) 和 ( ) y 是选自 1 和 2 的数字； R1 选自 H 或具有 0 至 2 个双键和 1 至 15 个碳原子的支链或直链饱和或不饱和烃基。 R2 选自 H 和具有 0 至 3 个双键和 1 至 15 个碳原子的支链或直链饱和或不饱和烃基。 R7、R8、R9、R10、R11 和 R12 中的每一个都独立选自 H 和具有 0 至 3 个双键和 1 至 15 个碳原子的支链或直链、饱和或不饱和烃基，且 n 是 1 至 12 的整数；且 环结构中 2 和 3 位置之间的键可以是单键或双键，其中结构（1）的化合物总共含有 11 至 20 个碳原子，但 R 为 =O、X = 和 y 为 1 的结构（I）的化合物总共含有 13 至 20 个碳原子。其中结构(1)的化合物含有 11 至 20 个总碳原子，但 R 为 =O、X = 和 y 为 1 的结构(I)的化合物含有 13 至 20 个总碳原子。 其中结构(1)的化合物含有 11 至 20 个总碳原子，但 R 为 =O、X = 和 y 为 1 的结构(I)的化合物含有 13 至 20 个总碳原子。
• Control and repellency of bed bugs
  申请人：BEDOUKIAN RESEARCH, INC.

  公开号：US10703705B2

  公开（公告）日：2020-07-07

  Control or repellency of bed bugs is accomplished by bringing the bed bugs into contact with at least one of the compounds of the structure (I); wherein R is selected from —OH, —OC(O)R4, —OR6, —(OR6)2, wherein each R6 is independently selected from an alkyl group containing from 1 to 4 carbon atoms and R4 is a branched or straight chain saturated or unsaturated hydrocarbyl group with zero to two double bonds and from 1 to 15 carbon atoms; X is O or CH2, with the proviso that when X is O R can only be =0; each Z is independently selected from (CH) and (CH2) y is a numeral selected from 1 and 2; R1 is selected from H or a branched or straight chain saturated or unsaturated hydrocarbyl group with zero to two double bonds and from 1 to 15 carbon atoms. R2 is selected from H and a branched or straight chain saturated or unsaturated hydrocarbyl group with zero to three double bonds and from 1 to 15 carbon atoms. R3 is selected from H, a branched or straight chain, saturated or unsaturated hydrocarbyl group with zero to three double bonds and from 1 to 15 carbon atoms, —(CH2)nOH, —C(O)OR5, —CH2C(O)OR7, —CH2C(O)R8, —C(O)NR9R10, —CH2C(O)NR11R12 where each of R5, R7, R8, R9, R10, R11 and R12 is independently selected from H and a branched or straight chain, saturated or unsaturated hydrocarbyl group with zero to three double bonds and from 1 to 15 carbon atoms, and n is an integer of from 1 to 12; and the bond between the 2 and 3 positions in the ring structure may be a single or a double bond, and wherein the compounds of structure (1) contain from 11 to 20 total carbon atoms, except where R is ═O, X═CH2 and y is 1 the compounds of structure (I) contain from 13 to 20 total carbon atoms in the compounds, wherein the compounds of structure (1) contain from 11 to 20 total carbon atoms, except where R is ═O, X═CH2 and y is 1 the compounds of structure (I) contain from 13 to 20 total carbon atoms in the compounds, wherein the compounds of structure (1) contain from 11 to 20 total carbon atoms, except where R is =0, X═CH2 and y is 1 the compounds of structure (I) contain from 13 to 20 total carbon atoms in the compounds.

  通过使臭虫接触至少一种结构(I)的化合物来达到控制或驱避臭虫的目的；其中R选自-OH、-OC(O)R4、-OR6、-(OR6)2，其中每个R6独立地选自含有1至4个碳原子的烷基，R4是具有0至2个双键和1至15个碳原子的支链或直链饱和或不饱和烃基；X是O或CH2，但当X是O时，R只能是＝0；每个Z独立地选自(CH)和( )y是选自1和2的数字；R1选自H或具有0至2个双键和1至15个碳原子的支链或直链饱和或不饱和烃基。R2 选自 H 和具有 0 至 3 个双键和 1 至 15 个碳原子的支链或直链饱和或不饱和烃基。R3 选自 H、具有 0 至 3 个双键和 1 至 15 个碳原子的支链或直链饱和或不饱和烃基、-( )nOH、-C(O)OR5、- C(O)OR7、- C(O)R8、-C(O)NR9R10、- C(O)NR11R12，其中 R5、R7、R8、R9、R10、R11、R12 中的每一个、R7、R8、R9、R10、R11 和 R12 都独立选自 H 和具有 0 至 3 个双键和 1 至 15 个碳原子的支链或直链、饱和或不饱和烃基，且 n 是 1 至 12 的整数；且环结构中 2 和 3 位置之间的键可以是单键或双键，其中结构（1）的化合物总共含有 11 至 20 个碳原子，但 R 为 ═O、X═ 和 y 为 1 的结构（I）的化合物总共含有 13 至 20 个碳原子的化合物除外，其中结构（1）的化合物总共含有 11 至 20 个碳原子、除了 R 为═O、X═ 和 y 为 1 的结构(I)化合物中含有 13 至 20 个总碳原子，其中结构(1)化合物中含有 11 至 20 个总碳原子，除了 R 为＝0、X═ 和 y 为 1 的结构(I)化合物中含有 13 至 20 个总碳原子。
• Feeding deterrence of pests such as Hemiptera, Lepidoptera and Coleoptera
  申请人：BEDOUKIAN RESEARCH, INC.

  公开号：US11224223B2

  公开（公告）日：2022-01-18

  Compounds are used as agents that deter feeding by insect pests, such as Hemiptera, Lepidoptera and Coleoptera. Feeding deterrence is obtained by contact of the insect pests with at least one of the compounds of the structure (I) wherein R is —OH, ═O, —OC(O)R4, —OR6, or —(OR6)2, each R6 is independently an alkyl group containing from 1 to 4 carbon atoms and R4 is a branched or straight chain, saturated or unsaturated, hydrocarbyl group with zero to two double bonds and from 1 to 15 carbon atoms; X is O or CH2 with the proviso that when X is O, R can only be ═O; each Z is independently (CH) or (CH2); y is a numeral selected from 1 and 2; R1 is H or a branched or straight chain, saturated or unsaturated hydrocarbyl group with zero to two double bonds and from 1 to 15 carbon atoms; R2 is H or a branched or straight chain, saturated or unsaturated hydrocarbyl group with zero to three double bonds and from 1 to 15 carbon atoms; R3 is selected from H, a branched or straight chain, saturated or unsaturated hydrocarbyl group with zero to three double bonds and from 1 to 15 carbon atoms, —(CH2)nOH, —C(O)OR5, —CH2C(O)OR7, —CH2C(O)R8, —C(O)NR9R10, and —CH2C(O)NR11R12 where each of R5, R7, R8, R9, R10, R11 and R12 is independently selected from H and a branched or straight chain, saturated or unsaturated hydrocarbyl group with zero to three double bonds and from 1 to 15 carbon atoms and n is an integer of from 1 to 12; the bond between the 2 and 3 positions in the ring structure may be a single or a double bond; and wherein the compounds of structure (I) contain from 9 to 20 total carbon atoms in the compounds.

  化合物可用作阻止半翅目、鳞翅目和鞘翅目等害虫取食的制剂。通过害虫与至少一种结构式为 (I) 的化合物接触，可阻止害虫取食。 其中 R 是 -OH、═O、-OC(O)R4、-OR6 或 -(OR6)2，每个 R6 独立地是含有 1 至 4 个碳原子的烷基，R4 是具有 0 至 2 个双键和 1 至 15 个碳原子的支链或直链、饱和或不饱和的烃基；X 是 O 或 CH2，但当 X 是 O 时，R 只能是═O；每个 Z 独立地是（CH）或（ ）； y 是选自 1 和 2 的数字； R1 是 H 或具有 0 至 2 个双键和 1 至 15 个碳原子的支链或直链、饱和或不饱和烃基； R2 是 H 或具有 0 至 3 个双键和 1 至 15 个碳原子的支链或直链、饱和或不饱和烃基；R3 选自 H、具有 0 至 3 个双键和 1 至 15 个碳原子的支链或直链、饱和或不饱和烃基、-( )nOH、-C(O)OR5、- C(O)OR7、- C(O)R8、-C(O)NR9R10 和- C(O)NR11R12，其中 R5、R7、R8、R9、R10 和 R11R12 各自R7、R8、R9、R10、R11 和 R12 都独立选自 H 和具有 0 至 3 个双键和 1 至 15 个碳原子的支链或直链、饱和或不饱和烃基，且 n 为 1 至 12 的整数；环结构中 2 位和 3 位之间的键可以是单键或双键；结构（I）的化合物中总共含有 9 至 20 个碳原子。
• ANTIMICROBIAL AGENTS
  申请人：Bedoukian Research, Inc.

  公开号：EP2875141A1

  公开（公告）日：2015-05-27
• PESTICIDAL COMPOSITIONS AND METHODS OF USING SAME
  申请人：BEDOUKIAN RESEARCH, INC.

  公开号：US20160302413A1

  公开（公告）日：2016-10-20

  A method for controlling or killing pests (e.g., bed bugs). The method includes providing at a location a composition comprising a pest toxicant (e.g., permethrin or a pyrethroid) and an organic nitrogenous compound (e.g., histamine). The organic nitrogenous compound is capable of attracting, arresting, aggregating and/or altering the behavior of the pests at the location. A composition containing a pest toxicant (e.g., permethrin or a pyrethroid) and an organic nitrogenous compound (e.g., histamine) capable of attracting, arresting, aggregating and/or altering the behavior of one or more pests (e.g., bed bugs). A method of attracting, arresting, aggregating and/or altering the behavior of pests (e.g., bed bugs) at a location. The method includes providing at the location a composition comprising an organic nitrogenous compound (e.g., histamine). A composition containing an organic nitrogenous compound (e.g., histamine) capable of attracting, arresting, aggregating and/or altering the behavior of one or more pests (e.g., bed bugs).