에틸-2,2-디메틸-7-브로모헵타노에이트

에틸-2,2-디메틸-7-브로모헵타노에이트
에틸-2,2-디메틸-7-브로모헵타노에이트 구조식 이미지
카스 번호:
123469-92-1
한글명:
에틸-2,2-디메틸-7-브로모헵타노에이트
동의어(한글):
에틸-2,2-디메틸-7-브로모헵타노에이트
상품명:
ethyl-2,2-dimethyl-7-bromoheptanoate
동의어(영문):
ethyl 7-bromo-2,2-dimethylheptanoate;ETC-1002 intermediate 2;Bempedoic Acid Impurity 9;Bempedoic acid intermediate;Bempedoic Acid Intermediates;7-bromo-2,2-dimethylheptanoate;ethyl-2,2-dimethyl-7-bromoheptanoate;7-Bromo-2,2-dimethylheptanoic acid ethyl ester;Heptanoic acid, 7-bromo-2,2-dimethyl-, ethyl ester;Toulene-4-Sulfonic Acid 2-Thiophne -2-Yl Ethyl Ester
CBNumber:
CB23105876
분자식:
C11H21BrO2
포뮬러 무게:
265.19
MOL 파일:
123469-92-1.mol

에틸-2,2-디메틸-7-브로모헵타노에이트 속성

끓는 점
106-108 °C(Press: 0.01 Torr)
밀도
1.169±0.06 g/cm3(Predicted)
InChI
InChI=1S/C11H21BrO2/c1-4-14-10(13)11(2,3)8-6-5-7-9-12/h4-9H2,1-3H3
InChIKey
SYRIIFZUZOIRNU-UHFFFAOYSA-N
SMILES
C(OCC)(=O)C(C)(C)CCCCCBr
안전
  • 위험 및 안전 성명
  • 위험 및 사전주의 사항 (GHS)
HS 번호 2915907098
그림문자(GHS): GHS hazard pictograms
신호 어: Warning
유해·위험 문구:
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드
H315 피부에 자극을 일으킴 피부부식성 또는 자극성물질 구분 2 경고 GHS hazard pictograms P264, P280, P302+P352, P321,P332+P313, P362
H319 눈에 심한 자극을 일으킴 심한 눈 손상 또는 자극성 물질 구분 2A 경고 GHS hazard pictograms P264, P280, P305+P351+P338,P337+P313P
예방조치문구:
P280 보호장갑/보호의/보안경/안면보호구를 착용하시오.
P302+P352 피부에 묻으면 다량의 물로 씻으시오.
P305+P351+P338 눈에 묻으면 몇 분간 물로 조심해서 씻으시오. 가능하면 콘택트렌즈를 제거하시오. 계속 씻으시오.
P332+P313 피부 자극이 생기면 의학적인 조치· 조언을 구하시오.
P337+P313 눈에 대한 자극이 지속되면 의학적인 조치· 조언를 구하시오.

에틸-2,2-디메틸-7-브로모헵타노에이트 C화학적 특성, 용도, 생산

개요

Ethyl 7-bromo-2,2-dimethylheptanoate is an important raw material in the synthesis route of bepetidic acid. Bempedoic acid, whose chemical name is 8-hydroxy-2,2,14,14-tetramethylpentadecanedioic acid, also known as ETC-1002, is a new type of lipid developed by the American EsperionTherapeutic company Quality regulation small molecule drugs. As one of the company's main drug candidates, its targets are liver adenosine triphosphate-citrate lyase (ACL) and adenosine monophosphate-activated protein kinase (AMPK).

용도

Ethyl-2,2-dimethyl-7-bromoheptanoate can be used as an intermediate in organic synthesis, mainly used in laboratory research and development and chemical production processes.

Synthesis

Synthesis_123469-92-1
The specific embodiment of the present invention is as follows: prepare 19.4g (167mmol) of ethyl isobutyrate in 216mL solution of tetrahydrofuran with a mass concentration of 10%, connect to metering pump 1; prepare 84mL (168mmol) of 2.0M n-butyllithium solution, connect to meter Pump 2; configure 1,5-dibromopentane 80.0g (348mmol) tetrahydrofuran 100mL solution, mass concentration is 63%, connected to metering pump 3.Configure 300mL of 1N hydrochloric acid solution and connect to metering pump 4.Set continuous flow precooler 1, the circulating temperature is 0, and reach stability; set continuous flow precooler 2, the circulating temperature is 0, and reach stability; set continuous flow precooler 3, and the circulating temperature is 0, and reach stability; set continuous flow precooler 4, cycle temperature is 0, and reach stability;Set the flow rate of metering pump 1 to 65.0ml/min, set the flow rate of metering pump 2 to 25.0ml/min, set the flow rate of metering pump 3 to 30.0ml/min, and set the flow rate of metering pump 4 to 90.0ml/min.Turn on the metering pump 1 and metering pump 2 at the same time. After 60s of operation, turn on the metering pump 3, and after 60s of operation, turn on the metering pump 4 to collect the outflowing reaction liquid in the storage tank.After the operation is completed, separate the liquids, collect the upper organic phase, concentrate under reduced pressure at P=-0.08MPa, T=45??C to remove low-boiling solvents, and then rectify under reduced pressure at P=5mmHg and T=70??C to obtain 38.4 g.The obtained product is a colorless liquid with a GC purity of 98.6% and a yield of 87%.

에틸-2,2-디메틸-7-브로모헵타노에이트 준비 용품 및 원자재

원자재

준비 용품


에틸-2,2-디메틸-7-브로모헵타노에이트 공급 업체

글로벌( 145)공급 업체
공급자 전화 이메일 국가 제품 수 이점
Jinan Carbotang Biotech Co.,Ltd.
+8615866703830
figo.gao@foxmail.com China 7154 58
weifang runzhong fine chemical co., ltd
536-7868377 +8618653686003
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AstaTech(Chengdu) Biopharmaceutical Corp.
+86-02882666559 +86-15884417729
gjpu@astatech.com.cn China 308 58
Shanghai Famo Biotech Co Ltd
+8618550473860
mayan@famobiotech.com China 509 58
Henan Fengda Chemical Co., Ltd
+86-371-86557731 +86-13613820652
info@fdachem.com China 20365 58
Capot Chemical Co.,Ltd.
571-85586718 +8613336195806
sales@capotchem.com China 29797 60
Speranza Chemical Co., Ltd.
+86-86-075521030354 +8618688942810
sophieliu@speranzachem.com China 723 55
career henan chemical co
+86-0371-86658258 15093356674;
factory@coreychem.com China 29826 58
Fuxin Pharmaceutical
+86-021-021-50872116 +8613122107989
contact@fuxinpharm.com China 10297 58
Zhengzhou Alfa Chemical Co.,Ltd
+8618530059196
sale04@alfachem.cn China 12855 58

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