기본 정보
- CAS
172336-32-2- 표준 SMILES
CCOC(=O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1- InChIKey
MAUQAXOHCVNUMX-SVKRATOZSA-N- 분자식
- C27H28FNO4
- 평균 분자량
- 449.5 g/mol
이름 및 식별자
- 우선 이름
- Pitavastatin Ethyl Ester
- IUPAC
- ethyl (E,3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoate
- 영어명
- Ethyl (E)-3,5-dihydroxy-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-hept-6-enoate
- 분자식
- C27H28FNO4
- 분자량
- 449.51
이름 및 동의어
Pitavastatin Ethyl Ester167073-19-0ethyl (E,3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoate(3R,5S,E)-ethyl 7-(2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl)-3,5-dihydroxyhept-6-enoate(3R,5S)-Ethyl 7-(2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl)-3,5-dihydroxyhept-6-enoate(E)-Ethyl 7-(2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl)-3,5-dihydroxyhept-6-enoate147008-20-6PitavastatinethylesterPitavastatin Impurity N2SCHEMBL2904607SCHEMBL30291805MAUQAXOHCVNUMX-SVKRATOZSA-N
이름 더 보기
Ethyl (E)-3,5-dihydroxy-7-[2-cyclopropyl-4-(4-fluorophenyl)-...Ethy(E)-3,5-dihydroxy-7-[2-cycloproyl-4-(4-fluorophenyl)-3-quinolinyl]-hept-6-enoateEthyl (E)-7-(2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl)-3,5-dihydroxyhept-6-enoateEthyl (E)-3,5-dihydroxy-7-[2-cyclopropyl-4-(4-flurophenyl)-3-quinolinyl]-hept-6-enoateETHYL (E)-3,5-DIHYDROXY-7-[2-CYCLOPROPYL-4-(4-FLUOROPHENYL)-3-QUINOLINYL]-HEPT-6-ENOATEethyl (6E)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoateEthyl (E)-3,5-dihydroxy-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-hept-6-enoater7(E)-3,5-Dihydroxy-7-[2-cycloPropyl-4-(4-Fluorophenyl)-3-quinolinyl]hept-6-enoic acid Ethyl ester(3R,5S)-7-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-3,5-dihydroxy-6-heptenoic acid ethyl ester
데이터베이스 식별자
- CAS
172336-32-2- PubChem CID
- 9824963
- EC Number
- 605-634-7
- Nikkaji
- J1.195.497I、J1.647.211E
물성
구조 계산 물성
- XLogP
- 4.2
- 극성 표면적
- 79.7 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 33
- 형식 전하
- 0
- 복잡도
- 661
물리화학적 성질
- 끓는 점
- 670.4 · 670.4±55.0 °C(Predicted)
- 밀도
- 1.271 · 1.271
- 저장 조건
- 2 · 2-8°C
- 산도 계수 (pKa)
- 13.79 · 13.79±0.20(Predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- 신호 어
- Warning
- 유해·위험 문구
- 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H302
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