기본 정보
- CAS
318-35-4- 표준 SMILES
CCOC(=O)c1c[nH]c2ccc(F)cc2c1=O- InChIKey
LNPRCADPRULVTR-UHFFFAOYSA-N- 분자식
- C12H10FNO3
- 평균 분자량
- 235.21 g/mol
- 단동위원소 질량
- 235.0644714
이름 및 식별자
- 우선 이름
- Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate
- IUPAC
- ethyl 6-fluoro-4-oxo-1H-quinoline-3-carboxylate
- 영어명
- ETHYL 6-FLUORO-4-HYDROXY-3-QUINOLINECARBOXYLATE
- 분자식
- C12H10FNO3
- 분자량
- 235.21
이름 및 동의어
ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate318-35-4DTXSID80351825RefChem:1084992DTXCID20302891ethyl 6-fluoro-4-oxo-1H-quinoline-3-carboxylate71083-00-6ethyl 6-fluoro-4-hydroxy-3-quinolinecarboxylateethyl 6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylateMFCD001733453-quinolinecarboxylic acid, 6-fluoro-4-hydroxy-, ethyl esterethyl 6-fluoro-1,4-dihydro-4-oxoquinoline-3-carboxylate
이름 더 보기
AURORA 17947BUTTPARK 18\09-692-ethyl-6-fluoro-4-oxo-1H-quinoline-3-carboxylate6-Fluoro-4-hydroxy-3-quinolinecarboxylicacidethylester6-FLUORO-4-HYDROXYQUINOLINE-3-CARBOXYLIC ACID ETHYL ESTER6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester
6-FLUORO-4-OXO-1,4-DIHYDRO-QUINOLINE-3-CARBOXYLIC ACID ETHYL ESTER3-Quinolinecarboxylic acid, 6-fluoro-1,4-dihydro-4-oxo-, ethyl esterethyl 6-fluoro-4-oxohydroquinoline-3-carboxylateOprea1_584923Oprea1_606154SCHEMBL538115SCHEMBL846416F0850-4895
데이터베이스 식별자
- CAS
318-35-4、71083-00-6- PubChem CID
- 710779
- DTXSID
DTXSID80351825- EC Number
- 681-664-4
- Nikkaji
- J1.363.396G、J2.184.420I
물성
구조 계산 물성
- XLogP
- 2.1
- 극성 표면적
- 55.4 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 17
- 형식 전하
- 0
- 복잡도
- 367
물리화학적 성질
- 녹는점
- 320 · 320-323°C
- 끓는 점
- 338.5 · 338.5±37.0 °C(Predicted)
- 밀도
- 1.353 · 1.353±0.06 g/cm3(Predicted)
- 저장 조건
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- 산도 계수 (pKa)
- 2.4 · 2.40±0.50(Predicted)
안전 및 규제
GHS 분류
GHS Classification
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 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
안전 데이터
- HS 번호
- 2933499090
- hazard_code
- Xi
- 위험 등급
- IRRITANT
화학 및 산업
공급사8 곳
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
苏州施亚生物科技有限公司17715136450 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
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