기본 정보
- CAS
4470-83-1- 표준 SMILES
Clc1ccc2cccc(Cl)c2n1- InChIKey
VAXOCTXTVIVOQE-UHFFFAOYSA-N- 분자식
- C9H5Cl2N
- 평균 분자량
- 198.05 g/mol
- 단동위원소 질량
- 196.9799046
이름 및 식별자
- 우선 이름
- 2,8-Dichloroquinoline
- IUPAC
- 2,8-dichloroquinoline
- 영어명
- 2,8-DICHLOROQUINOLINE
- 분자식
- C9H5Cl2N
- 분자량
- 198.05
이름 및 동의어
2,8-Dichloroquinoline4470-83-1DTXSID60350316RefChem:248962DTXCID80301385627-428-6Quinoline, 2,8-dichloro-MFCD008320772,8-dichloro-quinolineSCHEMBL8450372,8-Dichloroquinoline, 96%AS-18366
이름 더 보기
Obefazimod(ABX-464)2,8-Dichloroquinoline 96%2,8-DICHLOROQUINOLINE ISO 9001：2015 REACH
SY013566EN300-128589F0001-2437AMY38314BCP28043VAXOCTXTVIVOQFT-0635317A846621
데이터베이스 식별자
- CAS
4470-83-1- PubChem CID
- 676553
- DTXSID
DTXSID60350316- EC Number
- 627-428-6
- Nikkaji
- J2.226.049I
물성
구조 계산 물성
- XLogP
- 3.8
- 극성 표면적
- 12.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 163
물리화학적 성질
- 녹는점
- 105 · 105-108 °C (lit.)
- 끓는 점
- 292.8 · 292.8±20.0 °C(Predicted)
- 밀도
- 1.407 · 1.407±0.06 g/cm3(Predicted)
- 저장 조건
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- 산도 계수 (pKa)
- -2.33 · -2.33±0.50(Predicted)
- InChI
- InChI=1S/C9H5Cl2N/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5H
- InChIKey
- VAXOCTXTVIVOQE-UHFFFAOYSA-N
- SMILES
- N1C2C(=CC=CC=2Cl)C=CC=1Cl
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 2.3% (1 of 43) of reports.
Warning
H315 (97.7%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (97.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 43 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 1 of 43 reports by companies.；There are 5 notifications provided by 42 of 43 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
유해성 정보
Regulatory InformationStatus: Active Update: 21-09-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/32991
Hazard Classes and CategoriesSkin Irrit. 2 (97.7%)；Eye Irrit. 2 (97.7%)；STOT SE 3 (97.7%)
규제 정보
Regulatory InformationStatus: Active Update: 21-09-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/32991
안전 데이터
화학 및 산업
응용 분야
용도2,8-Dichloroquinoline may be used in the neat synthesis of 8-chloro-2-(thiophen-2-ylsulfanyl)quinolone. It may also be used in the preparation of 2-methyl-4-[-2′-(8′-chloroquinolyl)]-but-3-yn-2-ol.
일반 설명2,8-Dichloroquinoline can be synthesized from the reaction between 8-chloroquinoline-N-oxide and phosphoryl trichloride.
상·하류 제품 정보
하류 제품
공급사100 곳
河北凡博医药科技有限公司15588346797 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Suzhou Victorypharm Co.,Ltd.+86-13916956214 · [email protected]
环生美森医药技术（山东）有限公司0531-88762217 18301471076 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
上海瀚麟生物科技有限公司183-0212-4410 18302124410 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
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