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기본 정보
- CAS
98349-25-8- 표준 SMILES
CCOC(=O)c1cn(C2CC2)c2cc(F)c(F)cc2c1=O- InChIKey
QYGNYHKBMNUIJN-UHFFFAOYSA-N- 분자식
- C15H13F2NO3
- 평균 분자량
- 293.26 g/mol
- 단동위원소 질량
- 293.0863496
이름 및 식별자
- 우선 이름
- Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
- IUPAC
- ethyl 1-cyclopropyl-6,7-difluoro-4-oxoquinoline-3-carboxylate
- 영어명
- Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
- 분자식
- C15H13F2NO3
- 분자량
- 293.27
이름 및 동의어
98349-25-8ETHYL 1-CYCLOPROPYL-6,7-DIFLUORO-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLATEethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylateEC 422-380-0DTXSID50431269RefChem:593320DTXCID50382101422-380-0MFCD01646378ethyl 1-cyclopropyl-6,7-difluoro-4-oxoquinoline-3-carboxylateC15H13F2NO3SB71654
이름 더 보기
ethyl1-cyclopropyl-6,7-difluoro-4-oxoquinoline-3-carboxylateEthyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-quinolin-3-carboxylateEthyl 1-Cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylate1-Cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-quinoline-3-carboxylic Acid Ethyl Ester3-Quinolinecarboxylic acid, 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-, ethyl ester
ethyl 1-cyclopropyl-1,4-dihydro-6,7-difluoro-4-oxo-quinoline-3-carboxylateSCHEMBL4306583CHEMBL5562847SCHEMBL29576844Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-quinoline-3-carboxylateCL1050AKOS027325846DS-11689
물성
구조 계산 물성보충 중
- XLogP
- 2
- 극성 표면적
- 46.6 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 489
물리화학적 성질
- 녹는점
- 229 · 229-230℃ (ethyl acetate )
- 저장 조건
- Sealed in dry,Room Temperature
- InChI
- InChI=1S/C15H13F2NO3/c1-2-21-15(20)10-7-18(8-3-4-8)13-6-12(17)11(16)5-9(13)14(10)19/h5-8H,2-4H2,1H3
- InChIKey
- QYGNYHKBMNUIJN-UHFFFAOYSA-N
- SMILES
- N1(C2CC2)C2=C(C=C(F)C(F)=C2)C(=O)C(C(OCC)=O)=C1
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
유해성 정보
Regulatory InformationStatus: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/9190；Status: Active Update: 17-11-2014 https://echa.europa.eu/registration-dossier/-/registered-dossier/10623
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
규제 정보
Regulatory InformationStatus: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/9190；Status: Active Update: 17-11-2014 https://echa.europa.eu/registration-dossier/-/registered-dossier/10623
화학 및 산업
공급사53 곳
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
武汉贺景行生物科技有限公司027-13277920701 13277920701 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
咸宁深蓝生物医药研发有限公司18171815831 · [email protected]
Hubei Lidu New Material Technology Co., Ltd+86-19307248857 +86-19307248857 · [email protected]
南京道格生物医药科技有限公司025-58227606 18021503536 · [email protected]
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]
上海瀚香生物科技有限公司177-54423994 17754423994 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.
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