기본 정보
- CAS
194805-07-7- 표준 SMILES
CCOC(=O)c1cn(C2CC2)c2c(OC(F)F)c(Br)ccc2c1=O- InChIKey
ZVUUANRFLJIZGV-UHFFFAOYSA-N- 분자식
- C16H14BrF2NO4
- 평균 분자량
- 402.19 g/mol
- 단동위원소 질량
- 401.00743
이름 및 식별자
- 우선 이름
- Ethyl 7-bromo-1-cyclopropyl-8-(difluoromethoxy)-4-oxo-1,4-dihydro-3-quinolinecarboxylate
- IUPAC
- ethyl 7-bromo-1-cyclopropyl-8-(difluoromethoxy)-4-oxoquinoline-3-carboxylate
- 현지명
- 7-BROMO-1-CYCLOPROPYL-8-(DIFLUOROMETHOXY)-1,4-DIHYDRO-4-OXO-3-QUINOLINECARBOXYLICACID에틸에스테르
- 영어명
- 7-BROMO-1-CYCLOPROPYL-8-(DIFLUOROMETHOXY)-1,4-DIHYDRO-4-OXO-3-QUINOLINECARBOXYLIC ACID ETHYL ESTER
- 분자식
- C16H14BrF2NO4
- 분자량
- 402.19
이름 및 동의어
EC 438-080-8Ethyl 7-bromo-1-cyclopropyl-8-(difluoromethoxy)-4-oxo-1,4-dihydro-3-quinolinecarboxylateRefChem:595999438-080-8194805-07-7ETHYL 7-BROMO-1-CYCLOPROPYL-8-(DIFLUOROMETHOXY)-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLATEEthyl 7-bromo-1-cyclopropyl-8-difluoromethoxy-1,4-dihydro-4-oxoquinoline-3-carboxylate7-Bromo-1-cyclopropyl-8-(difluoromethoxy)-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid ethyl esterMFCD09743440Ethyl 7-bromo-1-cyclopropyl-8-(difluoromethoxy)-4-oxo-quinoline-3-carboxylateethyl 7-bromo-1-cyclopropyl-8-(difluoromethoxy)-4-oxoquinoline-3-carboxylateC16H14BrF2NO4
이름 더 보기
7-BROMO-1-CYCLOPROPYL-8-(DIFLUOROMETHOXY)-1,4-DIHYDRO-4-OXO-3-QUINOLINECARBOXYLICACID에틸에스테르7-Bromo-1-Cyclopropyl-8-(Difluoromethoxy)-1,4-Dihydro-4-Oxo-...ethyl7-bromo-1-cyclopropyl-8-(difluoromethoxy)-4-oxoquinoline-3-carboxylate7-bromo-1-cyclopropyl-8-(difluoromethoxy)-2-ethyl-4-oxo-3-quinolinecarboxylateethyl 7-bromo-1-cyclopropyl-8-difluoromethoxy-4-oxo-1,4-dihydro-3-quinoline-carboxylate7-bromo-1-cyclopropyl-8-difluoromethoxy-1,4-dihydro-4-oxoquinoline-3-carboxylic acid ethyl ester3-Quinolinecarboxylic acid, 7-bromo-1-cyclopropyl-8-(difluoromethoxy)-1,4-dihydro-4-oxo-, ethyl ester
SCHEMBL2081998DTXSID50471266AKOS016007560SB18232ETHYL-7-BROMO-1-CYCLOPROPYL-8-DIFLUOROMETHOXY-1,4-DIHYDRO-4-OXOQUINOLINE-3-CARBOXYLATEBS-49482NS00006555E76051
데이터베이스 식별자
- CAS
194805-07-7- PubChem CID
- 11732152
- DTXSID
DTXSID50471266- EC Number
- 438-080-8
- Nikkaji
- J2.156.034K
물성
구조 계산 물성
- XLogP
- 4.3
- 극성 표면적
- 55.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 24
- 형식 전하
- 0
- 복잡도
- 552
실험 및 물리화학적 성질
PFASPFAS -> Suspected persistent, mobile, toxic (PMT) PFAS or PFAS-like compounds
물리화학적 성질
- 끓는 점
- 477.4 · 477.4±45.0 °C(Predicted)
- 밀도
- 1.624 · 1.624
- 저장 조건
- 2 · 2-8°C
- 산도 계수 (pKa)
- -4.46 · -4.46±0.40(Predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory InformationREACH registered substance: Ethyl 7-bromo-1-cyclopropyl-8-(difluoromethoxy)-4-oxo-1,4-dihydro-3-quinolinecarboxylate (EC: 438-080-8)
화학 및 산업
공급사64 곳
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