2,2'-Bithiophene

HCID 68120CAS 492-97-7
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
c1csc(-c2cccs2)c1
InChIKey
OHZAHWOAMVVGEL-UHFFFAOYSA-N
분자식
C8H6S2
평균 분자량
166.3 g/mol
단동위원소 질량
165.99109219

개요

2,2'-bithiophene is a thiophene derivative that consists of two thiophene rings connected by a 2,2'-linkage.

이름 및 식별자

우선 이름
2,2'-Bithiophene
IUPAC
2-thiophen-2-ylthiophene
영어명
2,2'-BITHIOPHENE
분자식
C8H6S2
분자량
166.26

이름 및 동의어

2,2'-Bithiophene492-97-72,2'-BithienylDithienyl2-thiophen-2-ylthiophene2,2'-Dithienyl2,2'-Dithiophene2-(thiophen-2-yl)thiophenealpha-bithiophene2-(thien-2-yl)thiophene8CTS9HJ7L62,2'-bisthiophene
이름 더 보기
2T2THS10202,2-DITHIENYL2,2’-dlthienyl2,2'-Bithiophen
EINECS 207-767-2DTXSID8060084CHEBI:36821OHZAHWOAMVVGEL-UHFFFAOYSA-2,2'DithienylRefChem:80696DTXCID0040678207-767-2

데이터베이스 식별자

CAS
492-97-7
PubChem CID
68120
DTXSID
DTXSID8060084
ChEBI
CHEBI:36821
UNII
8CTS9HJ7L6
EC Number
207-767-2
Nikkaji
J100.273B

물성

구조 계산 물성

XLogP
3
극성 표면적
56.5 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
1
무거운 원자 수
10

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Thiophenes
LipidsFatty Acyls [FA] -> Oxygenated hydrocarbons [FA12]
SpringerMaterials PropertiesSchoenflies notation
LogP3.75
Vapor Pressure0.00119 [mmHg]
Physical DescriptionMelting point = 33 deg C; [ChemIDplus] Clear yellow to liquid; mp = 32-34 deg C; [Aldrich MSDS]

물리화학적 성질

녹는점
32 · 32-33 °C (lit.)
끓는 점
260 °C · 260 °C (lit.)
밀도
1.2455 · 1.2455 (rough estimate)
굴절률
1.621 · 1.6210 (estimate)
인화점
230 °F · >230 °F
저장 조건
Keep in dark place,Inert atmosphere,Room temperature

화학적 성질

white to light yellow crystal powder

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 14.3% (1 of 7) of reports.

Warning

H302 (14.3%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 7 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazards SummaryMay cause irritation; Not considered a dangerous material by the Globally Harmonized System (GHS); [Aldrich MSDS] See Thiophene.
Hazard Classes and CategoriesAcute Tox. 4 (14.3%)

안전 데이터

wgk
3
tsca
TSCA listed
HS 번호
29309090
risk_code
20/21/22-36/37/38
hazard_code
Xi,Xn
safety_code
22-24/25-36-26

화학 및 산업

용도 및 제조

General Manufacturing Information2,2'-Bithiophene: ACTIVE
응용 분야 · 3건

개요2,2'-bithiophene is an intermediate widely used for the synthesis of small molecules or polymer semiconductors in application of organic electronics.It has proven that2,2'-bithiophene exists as a mixture of the cis-like and the trans-like planar structures. 5,5'-positions of2,2'-bithiophene are easily accessible for bromination and stannylation to give 5,5'-dibromo-2,2'-bithiophene or 5,5'-trimethylstannyl-2,2'-bithiophene, which can be used for direct arylation reactions.

용도2,2'-Bithiophene is used as a precursor in the preparation of 5,5'-bis(trimethylstannyl)-2,2'-bithiophene , which is used for the synthesis of small molecules and polymer semiconductors for organic field-effect transistor (OFETs), organic light-emitting diode (OLED), Plastic Light Emitting Diode (PLED) and Organic Photovoltaic (OPV) applications. It is associated with aryl iodides and involved in rhodium catalyzed arylation of heteroarenes.

일반 설명2,2′-Bithiophene is an electron transporting material with the π-electrons present in the system that facilitate charge mobility.

상·하류 제품 정보

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
北京安司莫森技术有限公司010-82954736 13391601435 · [email protected]

추가 설명

정의ChEBI: A thiophene derivative that consists of two thiophene rings connected by a 2,2'-linkage.

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