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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Thionyl Chloride → HCID 178444550, 화합물

HRID 2351258
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HRID 2351258 반응식
C([C@H]1CC[C@H](C(Cl)=O)C1)CCCC.C(C1CC(=O)CCC1)CCCC.[CH2:26]([CH:31]1[CH2:35][CH2:34][CH:33]([C:36]([O:38][CH2:39][CH3:40])=[O:37])[CH2:32]1)[CH2:27][CH2:28][CH2:29][CH3:30].S(Cl)(Cl)=O.[CH2:45]([C@H:48]1[CH2:53][CH2:52][C@H:51]([C:54]2[CH:59]=CC(O)=[CH:56][CH:55]=2)[CH2:50][CH2:49]1)[CH2:46][CH3:47]>CCOCC.C1(C)C=CC=CC=1.N1C=CC=CC=1>[CH2:26]([C@H:31]1[CH2:35][CH2:34][C@H:33]([C:36]([O:38][C:39]2[CH:56]=[CH:55][C:54]([C@H:51]3[CH2:50][CH2:49][C@H:48]([CH2:45][CH2:46][CH3:47])[CH2:53][CH2:52]3)=[CH:59][CH:40]=2)=[O:37])[CH2:32]1)[CH2:27][CH2:28][CH2:29][CH3:30]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

9

반응물 5

HCID 24386Thionyl ChlorideHCID 242463Ethyl 3-pentylcyclopentanecarboxylateHCID 131838873-Pentylcyclohexan-1-oneHCID 86743430HCID 86743430, 화합물HCID 178447901HCID 178447901, 화합물

생성물 1

HCID 178444550HCID 178444550, 화합물

시약·촉매·용매 3

HCID 1049Pyridine용매
HCID 1140Toluene용매
HCID 3283Diethyl Ether용매

실험 절차

4.0 g of trans-3-n-pentylcyclopentanecarbonyl chloride (obtainable from 5-n-pentylcyclohexanone through chlorination, Faworski rearrangement of the α-chloroketone using sodium alcoholate in ether, hydrolysis of the ethyl 3-n-pentylcyclopentanecarboxylate, alkaline isomerization of the acid and subsequent reaction with thionyl chloride) are added dropwise at 100° to a solution of 4.4 g of 4-(trans-4-n-propylcyclohexyl)-phenol and 1.6 g of pyridine in 10 ml of toluene. The mixture is allowed to react for a further 3 hours, the pyridine hydrochloride is filtered off under suction, the filtrate is washed with water and dried, and the solvent is evaporated. The residue is crystallized from ethanol. 4-(trans-4-propylcyclohexyl)-phenyl trans-3-pentylcyclopentanecarboxylate is obtained; smectic B/isotropic phase transition: 49°.

후처리

  1. customto react for a further 3 hours
  2. filtrationthe pyridine hydrochloride is filtered off under suction
  3. washthe filtrate is washed with water
  4. customdried
  5. customthe solvent is evaporated
  6. customThe residue is crystallized from ethanol

출처 및 근거

ORD 기록
ord-6fc0bf298f704e149b32480576230238
출처 데이터셋
uspto-grants-1989_10
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US04873019

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