3-[[(4-Chlorophenyl)methyl]thio]-4-ethyl-5-[[3-(trifluoromethyl)phenoxy]methyl]-4H-1,2,4-triazole
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기본 정보
- CAS
383146-70-1- 표준 SMILES
CCn1c(COc2cccc(C(F)(F)F)c2)nnc1SCc1ccc(Cl)cc1- InChIKey
AMTGXEARANHBCD-UHFFFAOYSA-N- 분자식
- C19H17ClF3N3OS
- 평균 분자량
- 427.879 g/mol
- 단동위원소 질량
- 427.0732955
이름 및 식별자
- 우선 이름
- 3-[[(4-Chlorophenyl)methyl]thio]-4-ethyl-5-[[3-(trifluoromethyl)phenoxy]methyl]-4H-1,2,4-triazole
- IUPAC
- 3-{[(4-Chlorophenyl)methyl]sulfanyl}-4-ethyl-5-{[3-(trifluoromethyl)phenoxy]methyl}-4H-1,2,4-triazole
- 영어명
- (5-[(4-CHLOROBENZYL)SULFANYL]-4-ETHYL-4H-1,2,4-TRIAZOL-3-YL)METHYL 3-(TRIFLUOROMETHYL)PHENYL ETHER
- 분자식
- C19H17ClF3N3OS
- 분자량
- 427.87
이름 및 동의어
3-[(4-CHLOROBENZYL)SULFANYL]-4-ETHYL-5-([3-(TRIFLUOROMETHYL)PHENOXY]METHYL)-4H-1,2,4-TRIAZOLE(5-[(4-CHLOROBENZYL)SULFANYL]-4-ETHYL-4H-1,2,4-TRIAZOL-3-YL)METHYL 3-(TRIFLUOROMETHYL)PHENYL ETHER4H-1,2,4-Triazole, 3-[[(4-chlorophenyl)methyl]thio]-4-ethyl-5-[[3-(trifluoromethyl)phenoxy]methyl]-3-{[(4-chlorophenyl)methyl]sulfanyl}-4-ethyl-5-{[3-(trifluoromethyl)phenoxy]methyl}-4H-1,2,4-triazole
데이터베이스 식별자
- CAS
383146-70-1- PubChem CID
- 3744425
- DTXSID
DTXSID501115790
물성
물리화학적 성질
- 끓는 점
- 555 · 555.0±60.0 °C(Predicted)
- 밀도
- 1.35 · 1.35±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 0.95 · 0.95±0.10(Predicted)
관련 반응
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