기본 정보
- CAS
1631030-77-7- 표준 SMILES
CCOC(=O)c1cn(CCO)c(-c2ccccc2C(F)(F)F)c1C- InChIKey
ADDMHJWIKBOFAH-UHFFFAOYSA-N- 분자식
- C17H18F3NO3
- 평균 분자량
- 341.32 g/mol
이름 및 식별자
- 우선 이름
- ethyl 1-(2-hydroxyethyl)-4-methyl-5-[2-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxylate
- IUPAC
- ethyl 1-(2-hydroxyethyl)-4-methyl-5-[2-(trifluoromethyl)phenyl]pyrrole-3-carboxylate
- 영어명
- 1H-Pyrrole-3-carboxylic acid, 1-(2-hydroxyethyl)-4-methyl-5-[2-(trifluoromethyl)phenyl]-, ethyl ester
- 분자식
- C17H18F3NO3
- 분자량
- 341.32
이름 및 동의어
1631030-77-7ethyl 1-(2-hydroxyethyl)-4-methyl-5-[2-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxylate1H-Pyrrole-3-carboxylic acid, 1-(2-hydroxyethyl)-4-methyl-5-[2-(trifluoromethyl)phenyl]-, ethyl esterethyl 1-(2-hydroxyethyl)-4-methyl-5-(2-(trifluoromethyl)phenyl)-1H-pyrrole-3-carboxylateSCHEMBL16549388ADDMHJWIKBOFAH-UHFFFAOYSA-NEthyl 1-(2-Hydroxyethyl)-4-methyl-5-[2-(trifluoromethyl)phenyl]pyrrole-3-carboxylateSY286247DB-384989
데이터베이스 식별자
- CAS
1631030-77-7- Nikkaji
- J3.642.558J
물성
구조 계산 물성
- XLogP
- 3
- 극성 표면적
- 51.5 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 24
- 형식 전하
- 0
- 복잡도
- 430
화학 및 산업
공급사14 곳
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
Shanghai Innopharm Industrial Co., Ltd.+86-21-59960785 +86-17701845089 · [email protected]
上海凌凯科技股份有限公司58950110 13124863828 · [email protected]
北京桦冠医药科技有限公司17302533743 · [email protected]
NANJING YINGWEN BIOTECHNOLOGY CO LTD+8613382787392 · [email protected]
重庆德诚永道医药有限公司18523159912 19923264860 · [email protected]
Wuhan Jingkang en Biomedical Technology Co., Ltd+86-0086-13720134139 · [email protected]
陕西晶和医药科技有限公司029-86062279 13324594253 · [email protected]
湖北赛恩斯化工有限公司15994282563 15994282563 · [email protected]
韶远科技(上海)有限公司4000665055 · [email protected]
ANHUI CHICO CHEMICAL CO., LTD.13057662806 · [email protected]
武汉纽瑞斯医药科技有限公司13872091715; 13872091715 · [email protected]
淄博航宇生物科技发展有限公司+86-0533-2185556 +86-15965530500 · [email protected]
北京珐默兹医药科技有限公司
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