6-메톡시-1-테트라론

6-메톡시-1-테트라론
6-메톡시-1-테트라론 구조식 이미지
카스 번호:
1078-19-9
한글명:
6-메톡시-1-테트라론
동의어(한글):
6-메톡시-1-테트라론;6-메톡시-1,2,3,4-테트라히드로나프탈렌-1-온
상품명:
6-methoxy-1-tetralone
동의어(영문):
6-Methoxy-3,4-dihydronaphthalen-1(2H)-one;6-METHOXY-1-TETRALONE;1(2H)-NAPHTHALENONE, 3,4-DIHYDRO-6-METHOXY-;6-Methoxy;6-METHOXY-3,4-DIHYDRO-2H-NAPHTHALEN-1-ONE;6-Methoxy-3,4-dihydro-1(2H)-naphthalenone;6-METHOXY-1,2,3,4-TETRAHYDRONAPHTHALEN-1-ONE;6-Methoxy-tetalone;6-Methoxy-1-tetraL;6-METHOXY TETRALONE
CBNumber:
CB0277174
분자식:
C11H12O2
포뮬러 무게:
176.21
MOL 파일:
1078-19-9.mol

6-메톡시-1-테트라론 속성

녹는점
77-79 °C (lit.)
끓는 점
171 °C/11 mmHg (lit.)
밀도
1.0558 (rough estimate)
굴절률
1.5250 (estimate)
인화점
171°C/11mm
저장 조건
Sealed in dry,Room Temperature
물리적 상태
미세 결정성 분말
색상
노란색에서 밝은 갈색까지
수소이온지수(pH)
5.96 at 23℃ and 10g/L
Merck
14,6000
BRN
972739
InChIKey
MNALUTYMBUBKNX-UHFFFAOYSA-N
CAS 데이터베이스
1078-19-9(CAS DataBase Reference)
NIST
1(2H)-Naphthalenone, 3,4-dihydro-6-methoxy-(1078-19-9)
EPA
1(2H)-Naphthalenone, 3,4-dihydro-6-methoxy- (1078-19-9)
안전
  • 위험 및 안전 성명
  • 위험 및 사전주의 사항 (GHS)
위험품 표기 Xn,Xi
위험 카페고리 넘버 22-36/37/38-20/21/22
안전지침서 24/25-36-26
WGK 독일 3
위험 참고 사항 Irritant
TSCA Yes
HS 번호 29145000
그림문자(GHS): GHS hazard pictograms
신호 어: Warning
유해·위험 문구:
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드
H302 삼키면 유해함 급성 독성 물질 - 경구 구분 4 경고 GHS hazard pictograms P264, P270, P301+P312, P330, P501
예방조치문구:
P261 분진·흄·가스·미스트·증기·...·스프레이의 흡입을 피하시오.
P284 호흡 보호구를 착용하시오.
P304+P340 흡입하면 신선한 공기가 있는 곳으로 옮기고 호흡하기 쉬운 자세로 안정을 취하시오.
P342+P311 호흡기 증상이 나타나면 의료기관(의사)의 진찰을 받으시오.
NFPA 704
0
0 0

6-메톡시-1-테트라론 MSDS


6-Methoxytetralone

6-메톡시-1-테트라론 C화학적 특성, 용도, 생산

화학적 성질

yellow to light brown fine crystalline powder

용도

6-Methoxy-1-tetralone is a reagent useful in the synthesis of (2-(furanyl)vinyl)-1-tetralone chalcones which possesses anticancer agents and inducers of apoptosis.

제조 방법

(1) Reacting anisole with an acylating agent in Lewis acid and a solvent at the temperature of-10-40 ℃ to generate an intermediate 1, wherein the molar ratio of the Lewis acid to the acylating agent to the anisole is 1-10: 1-10: 1, the Lewis acid is selected from one or more of concentrated sulfuric acid, phosphoric acid, polyphosphoric acid, zinc chloride, aluminum trichloride, superacid and heteropoly acid;
(2) the intermediate 1 does not need to be separated, the temperature is raised to 70-120 ℃, and the intermediate 1 continues to react to generate 6-methoxy-1-tetralone;
(3) cooling the reaction product, adding water to stop the reaction, extracting, purifying and desolventizing to obtain a crude product of the 6-methoxy-1-tetralone, and refining the crude product by a solvent to obtain a high-purity product.

Synthesis Reference(s)

Journal of the American Chemical Society, 64, p. 94, 1942 DOI: 10.1021/ja01253a025
Tetrahedron Letters, 9, p. 2917, 1968 DOI: 10.1016/S0040-4039(00)89611-2

Synthesis

The synthesis of 6-methoxy-1-tetralone is as follows:Eaton's reagent (1.00 mL, 5.31 mmol) was added slowly to a stirred solution of methyl 4-(3-methoxyphenyl)butanoate (4; 0.37g, 1.78 mmol) in DCE (1 mL). The resulting mixture was stirred at 75 °C for 2h under N2 atmosphere. Then, the reaction mixture was allowed to reach room temperature, and was poured over ice-water and extracted with EtOAc (3 × 15 mL). The combined organic extracts were washed successively with brine (2 × 15 mL) and H2O (2 × 20 mL), filtered over Na2SO4 and concentrated under reduced pressure. The resulting brownish oil was fractionated by column chromatography (silica gel, EtOAc-hexanes, 1:9) to obtain 6-methoxy-1-tetralone as ayellowish oil; yield: 0.28 g (91%).    1078-19-9.png

6-메톡시-1-테트라론 준비 용품 및 원자재

원자재

준비 용품


6-메톡시-1-테트라론 공급 업체

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