2-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
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기본 정보
- CAS
271798-73-3- 표준 SMILES
Cn1nnnc1SCC(=O)Nc1cccc(C(F)(F)F)c1- InChIKey
WYYOHIHESUZJDM-UHFFFAOYSA-N- 분자식
- C11H10F3N5OS
- 평균 분자량
- 317.29 g/mol
- 단동위원소 질량
- 317.05581562
이름 및 식별자
- 우선 이름
- 2-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
- IUPAC
- 2-(1-methyltetrazol-5-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide
- 영어명
- 2-[(1-METHYL-1H-1,2,3,4-TETRAAZOL-5-YL)SULFANYL]-N-[3-(TRIFLUOROMETHYL)PHENYL]ACETAMIDE
- 분자식
- C11H10F3N5OS
- 분자량
- 317.29
이름 및 동의어
271798-73-32-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide2-((1-Methyl-1h-tetrazol-5-yl)thio)-N-(3-(trifluoromethyl)phenyl)acetamide2-(1-methyltetrazol-5-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide2-[(1-methyl-1H-1,2,3,4-tetraazol-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamideWYYOHIHESUZJDM-UHFFFAOYSA-NSTK733095AKOS001431944JS-0066UPCMLD0ENAT5966912:001ST019004CS-0300652
이름 더 보기
Acetamide, 2-[(1-methyl-1H-tetrazol-5-yl)thio]-N-[3-(trifluoromethyl)phenyl]-
AA-768/30961014Z18520254Acetamide, 2-(1-methyl-1H-tetrazol-5-ylthio)-N-(3-trifluoromethylphenyl)-2-(1-methyl(1,2,3,4-tetraazol-5-ylthio))-N-[3-(trifluoromethyl)phenyl]acetamid e2-[(1-Methyl-1H-tetraazol-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide2-[(1-Methyl-1H-tetraazol-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide #2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
데이터베이스 식별자
- CAS
271798-73-3- PubChem CID
- 582166
물성
구조 계산 물성보충 중
- XLogP
- 2.2
- 극성 표면적
- 98 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 370
물리화학적 성질
- 밀도
- 1.53 · 1.53±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 12.36 · 12.36±0.70(Predicted)
관련 반응
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