6-Chloroquinoline

HCID 69163CAS 612-57-7

기본 정보

표준 SMILES
Clc1ccc2ncccc2c1
InChIKey
GKJSZXGYFJBYRQ-UHFFFAOYSA-N
분자식
C9H6ClN
평균 분자량
163.6 g/mol
단동위원소 질량
163.01887687

이름 및 식별자

우선 이름
6-Chloroquinoline
IUPAC
6-chloroquinoline
영어명
6-CHLOROQUINOLINE
분자식
C9H6ClN
분자량
163.6

이름 및 동의어

6-Chloroquinoline612-57-7Quinoline, 6-chloro-CCRIS 3981UNII-K4A4BAU5SEK4A4BAU5SENSC 4682EINECS 210-314-1NSC-4682Quinoline, 6-chloro-,CHLOROQUINOLINE, 6-DTXSID3060611
이름 더 보기
AKOS 1006-chloro-quinolin6- chlorinequinoline6-Chloroquinoline,99%6-Chloroquinoline >6-CHLOROQUINOLINE ISO 9001:2015 REACH
RefChem:104456DTXCID7042984210-314-1GKJSZXGYFJBYRQ-UHFFFAOYSA-NInChI=1/C9H6ClN/c10-8-3-4-9-7(6-8)2-1-5-11-9/h1-6MFCD000240246-chloro-quinolineNSC4682

데이터베이스 식별자

CAS
612-57-7
PubChem CID
69163
DTXSID
DTXSID3060611
UNII
K4A4BAU5SE
EC Number
210-314-1
Nikkaji
J95.375J

물성

구조 계산 물성

XLogP
2.7
극성 표면적
12.9 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
0
무거운 원자 수
11

실험 및 물리화학적 성질

SpringerMaterials PropertiesCrystal structure
LogP2.73

물리화학적 성질

녹는점
41 · 41-43 °C (lit.)
끓는 점
126 · 126-127 °C/10 mmHg (lit.)
밀도
1.2108 · 1.2108 (rough estimate)
굴절률
1.611 · 1.6110 (estimate)
인화점
230 °F · >230 °F
저장 조건
Inert atmosphere,Room Temperature

화학적 성질

beige to brown crystals

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 48 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk
3
tsca
TSCA listed
HS 번호
29334900
risk_code
36/37/38
hazard_code
Xi
safety_code
26-37/39

화학 및 산업

용도 및 제조

General Manufacturing InformationQuinoline, 6-chloro-: INACTIVE
응용 분야 · 3건

용도6-chloroquinoline is a useful research chemical.

용도6-Chloroquinoline may be used in the synthesis of 3-methyl-3H-imidazo[4,5-f]quinolin-2-amine. It may be used as catalyst for high yield preparation of ethoxycarbonyl isothiocyanate.

일반 설명The standard molar enthalpy of formation of 6-chloroquinoline has been derived from the standard molar enthalpy of combustion and was evaluated in terms of molecular structure. Its arylation reaction with diamine derivatives of adamantanes in the presence of palladium catalyst has been reported to afford N,N′-diaryl derivatives.

제조 방법 · 1건

All the reactions were carried out in a 50 mL stainless steel autoclave . A mixture of glycerol (1 g, 1 equiv.), aniline (0.58 g, 0.5 equiv.), water (2.5 mL) and W-KIT-6 (100 mg) was charged in to the autoclave simultaneously and finally heated to 200 °C with stirring for 3 h. On completion of the reaction (monitored by TLC), the autoclave was cooled to room temperature and the catalyst was removed by filtration. Ethyl acetate (10 mL) and water (5 mL) were added to the reaction mixture and stirred well for few minutes. The organic layer was dried over anhydrous Na2SO4 and the crude was purified by column chromatography using 60-120 mesh silica with ethylacetate/hexane as eluent to afford 6-chloroquinoline in good yield.

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
常州思丹德化工有限公司0519-85607885 13776800733 · [email protected]

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