ethyl 5-[2-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxylate

HCID 66924625

기본 정보

표준 SMILES
CCOC(=O)c1c[nH]c(-c2ccccc2C(F)(F)F)c1
InChIKey
PPCGUPCIKSHNDF-UHFFFAOYSA-N
분자식
C14H12F3NO2
평균 분자량
283.24 g/mol
단동위원소 질량
283.08201311

이름 및 식별자

우선 이름
ethyl 5-[2-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxylate
IUPAC
ethyl 5-[2-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxylate

이름 및 동의어

881673-54-7ethyl 5-[2-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxylateMFCD11875794Ethyl 5-(2-(trifluoromethyl)phenyl)-1H-pyrrole-3-carboxylateEthyl5-[2-(Trifluoromethyl)phenyl]-1H-pyrrole-3-carboxylateSCHEMBL1156085SCHEMBL30740953AC7071AKOS037630084SY129453CS-0457776F777636
이름 더 보기
ethyl 5-(2-trifluoromethylphenyl)-1H-pyrrole-3-carboxylate5-(2-Trifluoromethyl-phenyl)-1H-pyrrole-3-carboxylic acid ethyl ester5-(2-Trifluoromethyl-phenyl)-1H-pyrrole-3-carboxylic acid ethyl ester, 95%

데이터베이스 식별자

PubChem CID
66924625

물성

구조 계산 물성

XLogP
3.5
극성 표면적
42.1 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
5
회전 가능 결합 수
4
무거운 원자 수
20

관련 반응

4건

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