홈MCP워크벤치Skills
홈워크벤치알림마이페이지
llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
  1. 홈
  2. /반응

Acetamidine monohydrochloride → HCID 13271777, 화합물

HRID 464578
노트
인쇄 미리보기

반응식

HRID 464578 반응식
C[O-].[Na+].C([O:8][C:9]([CH:11]1[C:17]2[CH:18]=[CH:19][C:20]([Cl:22])=[CH:21][C:16]=2[C:15]([C:23]2[CH:28]=[CH:27][CH:26]=[CH:25][CH:24]=2)=[N:14][CH:13]=[CH:12]1)=O)CCC.C(OC(C1C2C=CC(Cl)=CC=2C(C2C=CC=CC=2)=NCC=1)=O)CCC.Cl.[C:55]([NH2:58])(=[NH:57])[CH3:56]>C(O)C.O.CO>[Cl:22][C:20]1[CH:19]=[CH:18][C:17]2[CH:11]3[C:9](=[O:8])[NH:58][C:55]([CH3:56])=[N:57][CH:12]3[CH2:13][N:14]=[C:15]([C:23]3[CH:24]=[CH:25][CH:26]=[CH:27][CH:28]=3)[C:16]=2[CH:21]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

8

반응물 4

HCID 67170Acetamidine monohydrochlorideHCID 10942334Sodium MethoxideHCID 13271771Butyl 8-chloro-1-phenyl-3H-2-benzazepine-5-carboxylateHCID 13271773Butyl 8-chloro-1-phenyl-5H-2-benzazepine-5-carboxylate

생성물 1

HCID 13271777HCID 13271777, 화합물

시약·촉매·용매 3

HCID 702
Ethanol
용매
HCID 887Methanol용매
HCID 962Water용매

실험 절차

In one portion, 11.5 mL (49 mmol) of a 4.34M methanol solution of sodium methoxide was added to a solution of 11.0 g (31 mmol) of a mixture of 8-chloro-1-phenyl-5H-2-benzazepine-5-carboxylic acid butyl ester and 8-chloro-1-phenyl-3H-2-benzazepine-5-carboxylic acid butyl ester and 5.7 g (60 mmol) of acetamidine hydrochloride in 200 mL of ethanol. The mixture was refluxed for 18 hr, cooled and poured into 800 mL of water. The resulting precipitate was collected by filtration and washed with ether to yield a yellow solid. Recrystallization from tetrahydrofuran gave off-white prisms, mp 155°-160°.

후처리

  1. temperatureThe mixture was refluxed for 18 hr
  2. temperaturecooled
  3. filtrationThe resulting precipitate was collected by filtration
  4. washwashed with ether
  5. customto yield a yellow solid
  6. customRecrystallization from tetrahydrofuran
  7. customgave off-white prisms, mp 155°-160°

출처 및 근거

ORD 기록
ord-76f4b5bdb3b647938af315da0b80d509
출처 데이터셋
uspto-grants-1985_10
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US04548750

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트