기본 정보
- CAS
121659-86-7- 표준 SMILES
COC(=O)c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1- InChIKey
RNXQZVFWKIPEOJ-UHFFFAOYSA-N- 분자식
- C20H16FNO2
- 평균 분자량
- 321.3 g/mol
- 단동위원소 질량
- 321.11650697
이름 및 식별자
- 우선 이름
- Methyl 2-cyclopropyl-4-(4-fluorophenyl)quinoline-3-carboxylate
- IUPAC
- methyl 2-cyclopropyl-4-(4-fluorophenyl)quinoline-3-carboxylate
- 현지명
- 메틸4-(4'-플루오로페닐)-2-(시클로프로필)-3-퀴놀린카르복실레이트
- 영어명
- Methyl 4-(4'-fluorophenyl)-2-(cyclopropyl)-3-quinolinecarboxylate
- 분자식
- C20H16FNO2
- 분자량
- 321.34
이름 및 동의어
121659-86-7Methyl 2-cyclopropyl-4-(4-fluorophenyl)quinoline-3-carboxylate4-(4-Fluorophenyl)-2-cyclopropylquinoline-3-carboxylic acid methyl esterMethyl 2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinecarboxylatePitavastatin Impurity 56Methyl 2-cyclopropyl-4-(4-fluorophenyl)-quinoline-3-carboxylate3-Quinolinecarboxylic acid, 2-cyclopropyl-4-(4-fluorophenyl)-, methyl esterMethyl 4-(4'-fluorophenyl)-2-(cyclopropyl)-3-quinolinecarboxylateC20H16FNO2RNXQZVFWKIPEOJ-UHFFFAOYSA-N2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinecarboxylic Acid Methyl Ester; 2-Cyclopropyl-4-(4-fluorophenyl)quinoline-3-carboxylic acid methyl ester; 4-(4-Fluorophenyl)-2-cyclopropylquinoline-3-carboxylic acid methyl ester; Methyl 2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinecarboxylateMFCD11041028
이름 더 보기
메틸4-(4'-플루오로페닐)-2-(시클로프로필)-3-퀴놀린카르복실레이트Methyl 2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinecarboxylatePitavastatin Impurity 664-(4'-fluorophenyl)-2-(cyclopropyl)-3-quinolinecarboxylatemethyl 4-(4'-fluorophenyl)-2-cyclopropylquinoline-3-carboxylateMETHYL 4-(4''-FLUOROPHENYL)-2-(CYCLOPROPYL)-3-QUINOLINECARBOXYLATE2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinecarboxylic Acid Methyl Ester2-Cyclopropyl-4-(4-fluorophenyl)quinoline-3-carboxylic acid methyl ester
SCHEMBL356302DTXSID40432604AKOS015900379AS-73314CS-0164808D95856Methyl2-cyclopropyl-4-(4-fluorophenyl)quinoline-3-carboxylatemethyl 2-cyclopropyl-4-(4'-fluorophenyl)quinoline-3-carboxylate
데이터베이스 식별자
- CAS
121659-86-7- PubChem CID
- 9901664
- DTXSID
DTXSID40432604- EC Number
- 601-796-8
- Nikkaji
- J1.646.460K
물성
구조 계산 물성
- XLogP
- 4.3
- 극성 표면적
- 39.2 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 24
- 형식 전하
- 0
- 복잡도
- 459
물리화학적 성질
- 녹는점
- 122 · 122-124°C
- 끓는 점
- 458.1 · 458.1±45.0 °C(Predicted)
- 밀도
- 1.274 · 1.274
- 저장 조건
- 2 · 2-8°C
- 용해도
- 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 3.43 · 3.43±0.50(Predicted)
- 색상
- 연한 노란색에서 밝은 노란색까지
화학적 성질
White Solid
안전 및 규제
안전 데이터
- 신호 어
- Warning
- 유해·위험 문구
- 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H302
화학 및 산업
응용 분야
용도Pitavastatin intermediate.
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