4-methyl-5-[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]-4H-1,2,4-triazole-3-thiol
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기본 정보
- CAS
338747-58-3- 표준 SMILES
Cn1c(-c2cc3c(C(F)(F)F)nn(C)c3s2)n[nH]c1=S- InChIKey
DGTHKCCCRANFBW-UHFFFAOYSA-N- 분자식
- C10H8F3N5S2
- 평균 분자량
- 319.3 g/mol
- 단동위원소 질량
- 319.01732211
이름 및 식별자
- 우선 이름
- 4-methyl-5-[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]-4H-1,2,4-triazole-3-thiol
- IUPAC
- 4-methyl-3-[1-methyl-3-(trifluoromethyl)thieno[3,2-d]pyrazol-5-yl]-1H-1,2,4-triazole-5-thione
- 영어명
- 4-METHYL-5-[1-METHYL-3-(TRIFLUOROMETHYL)-1H-THIENO[2,3-C]PYRAZOL-5-YL]-4H-1,2,4-TRIAZOLE-3-THIOL
- 분자식
- C10H8F3N5S2
- 분자량
- 319.33
이름 및 동의어
338747-58-34-methyl-5-[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]-4H-1,2,4-triazole-3-thiolMLS000326634MFCD014440474-methyl-3-[1-methyl-3-(trifluoromethyl)thieno[2,3-c]pyrazol-5-yl]-1H-1,2,4-triazole-5-thioneSMR0001791404-Methyl-5-(1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol4-Methyl-5-[1-methyl-3-(trifluoromethyl)-1H- thieno[2,3-c]pyrazol-5-yl]-4H-1,2,4-triazole -3-thiolCHEMBL1378796BDBM80143cid_2775440HMS2161L15
이름 더 보기
4-Methyl-5-[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]-4H-1,2,4-triazole-3-thi4-methyl-5-[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]-4H-1,2,4-triazol-3-ylhydrosulfide3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-methyl-5-[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]-
HMS3315C12AKOS0050705234M-331SCS-03666154-Methyl-5-[1-Me-3-(TFM)-1H-thieno[2,3-c]pyrazol-5-yl]-4H-1,2,4-triazole-3-thiol4-methyl-3-[1-methyl-3-(trifluoromethyl)-5-thieno[2,3-c]pyrazolyl]-1H-1,2,4-triazole-5-thione4-Methyl-5-[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
데이터베이스 식별자
- CAS
338747-58-3- PubChem CID
- 2775440
- ChEMBL
CHEMBL1378796
물성
구조 계산 물성보충 중
- XLogP
- 2.6
- 극성 표면적
- 106 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 468
물리화학적 성질
- 녹는점
- 306 · 306-309°C
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- HS 번호
- 2933199090
- hazard_code
- Xi
- 위험 등급
- IRRITANT
관련 반응
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