2-Acetylthiophene

2-Acetylthiophene 구조식 이미지
카스 번호:
88-15-3
상품명:
2-Acetylthiophene
동의어(영문):
Ethanone, 1-(2-thienyl)-;2-Thienyl methyl ketone;AKOS 91936;2-Acetothienone;2-Acetylthioph;2-ACETYLTHIOLE;2-Acetylthiophen;1-(2-Thienyl)-1-ethanone;2-Acylthiophene;2-ACETOTHIOPHENE
CBNumber:
CB5259889
분자식:
C6H6OS
포뮬러 무게:
126.18
MOL 파일:
88-15-3.mol
MSDS 파일:
SDS

2-Acetylthiophene 속성

녹는점
10-11 °C (lit.)
끓는 점
214 °C (lit.)
밀도
1.168 g/mL at 25 °C (lit.)
증기압
2.7 hPa (50 °C)
굴절률
n20/D 1.565(lit.)
인화점
196 °F
저장 조건
Store below +30°C.
용해도
14g/L
물리적 상태
액체
색상
투명한 연한 노란색에서 연한 갈색까지
냄새
100.00%에서. 유황, 견과류, 헤이즐넛, 호두
냄새 유형
유황의
생물학적 소스
synthetic
수용성
물에 불용성.
감도
Light Sensitive
BRN
107910
주요 응용
향료 및 향
InChI
1S/C6H6OS/c1-5(7)6-3-2-4-8-6/h2-4H,1H3
InChIKey
WYJOVVXUZNRJQY-UHFFFAOYSA-N
SMILES
CC(=O)c1cccs1
LogP
1.250
CAS 데이터베이스
88-15-3(CAS DataBase Reference)
NIST
Ethanone, 1-(2-thienyl)-(88-15-3)
EPA
Ethanone, 1-(2-thienyl)- (88-15-3)
안전
  • 위험 및 안전 성명
  • 위험 및 사전주의 사항 (GHS)
위험품 표기 T,Xi,Xn
위험 카페고리 넘버 25-23/24/25-20/21/22
안전지침서 45-38-36/37/39-28-36
유엔번호(UN No.) UN 2810 6.1/PG 2
WGK 독일 3
RTECS 번호 OB6300000
F 고인화성물질 13
자연 발화 온도 265 °C DIN 51794
위험 참고 사항 Irritant
TSCA TSCA listed
위험 등급 6.1
포장분류 II
HS 번호 29349990
스토리지 클래스 6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
Hazard Classifications Acute Tox. 2 Inhalation
Acute Tox. 2 Oral
Acute Tox. 3 Dermal
독성 LD50 orally in Rabbit: 25 - 200 mg/kg LD50 dermal Rat 370 mg/kg
그림문자(GHS): Skull and Crossbones (GHS06)
신호 어: Danger
유해·위험 문구:
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드
H311 피부와 접촉하면 유독함 급성 독성 물질 - 경피 구분 3 위험 P280, P302+P352, P312, P322, P361,P363, P405, P501
예방조치문구:
P260 분진·흄·가스·미스트·증기·...·스프레이를 흡입하지 마시오.
P264 취급 후에는 손을 철저히 씻으시오.
P264 취급 후에는 손을 철저히 씻으시오.
P270 이 제품을 사용할 때에는 먹거나, 마시거나 흡연하지 마시오.
P280 보호장갑/보호의/보안경/안면보호구를 착용하시오.
NFPA 704
2
1 0

2-Acetylthiophene MSDS


2-Acetylthiophene

2-Acetylthiophene C화학적 특성, 용도, 생산

화학적 성질

clear colorless to slightly yellow liquid

용도

2-Acetylthiophene(2AT) is used as an intermediate in the manufacturing of drugs like Tiamonium Iodide, Suprofan, Stepronin, Tenonitrozole, Namirotene, etc. 2AT is used as an important precursor to thiophene-2-acetic acid (T2AA) or its acid chloride (Cl) and thiophene-2-carboxylic acid (T2CA) (Cl). It is important that the process used to synthesize 2AT yields the lowest amount of 3- acetylthiophene isomer.

화학 반응

Although the condensation product of TeCl4 with 2-acetylthiophene, the bis(2-thiophenoylmethyl)tellurium dichloride has been obtained in poor yields, the reaction product of TeCl4 with 2-acetylpyridine still remains uncharacterized. These observations highlight the substantial role heteroaromatic moiety electronic factors play in the electrophilic reactions of their acetyl derivatives.[1]

Safety Profile

Poison by intraperitoneal route. A flammable liquid. When heated to decomposition emits toxic fumes of SOx,.

Solubility in organics

2-Acetylthiophene is miscible at 25°C with triethylene glycol, methanol, ethanol, n-butanol, diethyl ether, dioxane, cellulose butyl ester, ethyl acetate, acetone, acetonitrile, carbon disulphide, carbon tetrachloride, nitromethane, acetic acid, thiophene, tetranaphthalene, aminobenzene, and benzene . It is immiscible with water, glycerol, ethylene glycol, decahydronaphthalene, cyclohexane, diisobutylene, 1-hexadecene, and n-heptane. When equal volumes are mixed, 2-acetylthiophene is miscible with n-heptane above 60.8°C and with ethylene glycol above 31.1°C.
[1] JOHNSON G C. Physical Properties of 2-Acetylthiophene[J]. Journal of the American Chemical Society, 1947, 69 1: 150-152. DOI:10.1021/ja01193a040.

Purification Methods

Fractionally distil the thiophene through a 12-plate column, and fraction b 77o/4mm is collected. Also wet the acetylthiophene in order to remove and free thiophene which forms an azeotrope with H2O, b 68o. Store it in a brown bottle, and the clear colourless liquid remains thus for extended periods. [Kosak & Hartough Org Synth Coll Vol III 14 1955, Hartough & Kosak J Am Chem Soc 69 3093 1947.] The red 4-nitrophenylhydrazone crystallises from EtOH with m 181-182o. [Beilstein 17/9 V 387.]

2-Acetylthiophene 준비 용품 및 원자재

원자재

준비 용품


2-Acetylthiophene 공급 업체

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