기본 정보
- CAS
321574-30-5- 표준 SMILES
CCOC(=O)c1c(C#N)cnn1-c1ncc(C(F)(F)F)cc1Cl- InChIKey
DTSDHXFVTXFENA-UHFFFAOYSA-N- 분자식
- C13H8ClF3N4O2
- 평균 분자량
- 344.67 g/mol
이름 및 식별자
- 우선 이름
- ethyl 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-cyano-1H-pyrazole-5-carboxylate
- IUPAC
- ethyl 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-cyanopyrazole-5-carboxylate
- 영어명
- Ethyl 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-cyano-1H-pyrazole-5-carboxylate
- 분자식
- C13H8ClF3N4O2
- 분자량
- 344.68
이름 및 동의어
321574-30-5ethyl 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-cyano-1H-pyrazole-5-carboxylateethyl 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-cyanopyrazole-3-carboxylateethyl 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-cyano-1H-pyrazole-5-carboxylateEthyl 1-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)-4-cyano-1H-pyrazole-5-carboxylateAKOS0051018398H-051ethyl1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-cyano-1H-pyrazole-5-carboxylate1H-Pyrazole-5-carboxylic acid, 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-cyano-, ethyl ester
데이터베이스 식별자
- CAS
321574-30-5
물성
구조 계산 물성
- XLogP
- 2.9
- 극성 표면적
- 80.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 23
- 형식 전하
- 0
- 복잡도
- 495
화학 및 산업
공급사3 곳
Ryan Scientific, Inc.[email protected]
Key Organics Ltd.[email protected]
BIONET-INTER[email protected]
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