기본 정보
- CAS
100568-02-3- 표준 SMILES
CNCC[C@H](Oc1ccc(C(F)(F)F)cc1)c1ccccc1- InChIKey
RTHCYVBBDHJXIQ-INIZCTEOSA-N- 분자식
- C17H18F3NO
- 평균 분자량
- 309.33 g/mol
- 단동위원소 질량
- 309.13404868
이름 및 식별자
- 우선 이름
- (S)-Fluoxetine
- IUPAC
- (3S)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine
- 영어명
- (S)-N-methyl-3-phenyl-3-(4-(trifluoromethyl)phenoxy)propan-1-amine
- 분자식
- C17H18F3NO
- 분자량
- 309.3261296
이름 및 동의어
(S)-Fluoxetine100568-02-3(-)-fluoxetine(S)-ProzacFluoxetine, (S)-Fluoxetine, (-)-(s)-n-methyl-3-(4-trifluoromethylphenoxy)-3-phenylpropylamine(S)-(-)-fluoxetine6MYD4C025QCHEBI:86992DTXSID60904656(S)-N-methyl-3-(4-trifluoromethylphenyloxy)-3-(phenyl)propylamine
이름 더 보기
(S)-N-methyl-3-phenyl-3-(4-(trifluoromethyl)phenoxy)propan-1-amineBenzenepropanamine, N-methyl-γ-[4-(trifluoromethyl)phenoxy]-, (γS)-
(S)-N-methyl-gamma-(4-trifluoromethylphenoxy)-3-phenylpropylamine(S)-N-methyl-3-phenyl-3-[(alpha,alpha,alpha-trifluoro-p-tolyl)oxy]propylaminemethyl[(3s)-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amineBenzenepropanamine, N-methyl-gamma-(4-(trifluoromethyl)phenoxy)-, (gammaS)-methyl((3S)-3-phenyl-3-(4-(trifluoromethyl)phenoxy)propyl)amine(S)-N-methyl-3-phenyl-3-((alpha,alpha,alpha-trifluoro-p-tolyl)oxy)propylamineRefChem:1051186DTXCID001333775
데이터베이스 식별자
- CAS
100568-02-3- PubChem CID
- 1548968
- DTXSID
DTXSID60904656- ChEMBL
CHEMBL1169388- ChEBI
CHEBI:86992- UNII
- 6MYD4C025Q
- Nikkaji
- J238.667D
물성
구조 계산 물성
- XLogP
- 4
- 극성 표면적
- 21.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 22
- 형식 전하
- 0
- 복잡도
- 308
물리화학적 성질
- 끓는 점
- 395.1 · 395.1±42.0 °C(Predicted)
- 밀도
- 1.159 · 1.159±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 10.05 · 10.05±0.10(Predicted)
화학 및 산업
약리 정보
Metabolism/Metabolites(s)-fluoxetine has known human metabolites that include (s)-Norfluoxetine, 3-(methylamino)-1-phenylpropan-1-one, and p-Trifluoromethyl phenol.
공급사4 곳
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
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山东子易医药有限公司13173053288 · [email protected]
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