3,5-Bis(m-trifluoromethylphenyl)-4-(2-hydroxyethoxy)benzoic acid ethyl ester

HCID 54098193

기본 정보

표준 SMILES
CCOC(=O)c1cc(-c2cccc(C(F)(F)F)c2)c(OCCO)c(-c2cccc(C(F)(F)F)c2)c1
InChIKey
MYQHTAVAVRWZCM-UHFFFAOYSA-N
분자식
C25H20F6O4
평균 분자량
498.4 g/mol

이름 및 식별자

우선 이름
3,5-Bis(m-trifluoromethylphenyl)-4-(2-hydroxyethoxy)benzoic acid ethyl ester
IUPAC
ethyl 4-(2-hydroxyethoxy)-3,5-bis[3-(trifluoromethyl)phenyl]benzoate

이름 및 동의어

3,5-bis(m-trifluoromethylphenyl)-4-(2-hydroxyethoxy)benzoic acid ethyl esterSCHEMBL59884373,5-bis(m-trifluoromethylphenyl)-4-(2-hydroxyethoxy)-benzoic acid ethyl ester3,5-bis-(m-trifluoromethylphenyl)-4-(2-hydroxyethoxy)-benzoic acid ethyl ester3,5-bis-(m-trifluoromethylphenyl)-4-(2-hydroxyethoxy)benzoic acid ethyl ester3,5-bis-(m-trifluoromethylphenyl)4-(2-hydroxyethoxy)-benzoic acid ethyl ester3,5-bis-(m-trifluoromethylphenyl)4-(2-hydroxyethoxy)benzoic acid ethyl ester

데이터베이스 식별자

PubChem CID
54098193

물성

구조 계산 물성

XLogP
6.4
극성 표면적
55.8 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
10
회전 가능 결합 수
8
무거운 원자 수
35

관련 반응

31건

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