기본 정보
- CAS
1018051-29-0- 표준 SMILES
Cc1nn(CC(F)F)c2[nH]c(=O)cc(C(F)(F)F)c12- InChIKey
OSHFJDWLFSWQRM-UHFFFAOYSA-N- 분자식
- C10H8F5N3O
- 평균 분자량
- 281.18 g/mol
- 단동위원소 질량
- 281.0587527
이름 및 식별자
- 우선 이름
- 1-(2,2-Difluoroethyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6(7H)-one
- IUPAC
- 1-(2,2-difluoroethyl)-3-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one
- 영어명
- 1-(2,2-difluoroethyl)-3-methyl-4-(trifluoromethyl)-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
- 분자식
- C10H8F5N3O
- 분자량
- 281.18
이름 및 동의어
1018051-29-01-(2,2-Difluoroethyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6(7H)-one1-(2,2-difluoroethyl)-3-methyl-4-(trifluoromethyl)-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one1-(2,2-DIFLUOROETHYL)-3-METHYL-4-(TRIFLUOROMETHYL)-7H-PYRAZOLO[3,4-B]PYRIDIN-6-ONEMFCD097015141-(2,2-difluoroethyl)-3-methyl-4-(trifluoromethyl)-1H,6H,7H-pyrazolo[3,4-b]pyridin-6-one1-(2,2-Difluoroethyl)-3-methyl-4-(trifluoromethyl)-1h-pyrazolo[3,4-b]pyridin-6-olC10H8F5N3OTQB05129SBB024937STK351879AKOS005167608
이름 더 보기
1-(2,2-difluoroethyl)-3-methyl-4-(trifluoromethyl)-1 H,6H,7H-pyrazolo[3,4-b]pyridin-6-one6H-Pyrazolo[3,4-b]pyridin-6-one, 1-(2,2-difluoroethyl)-1,7-dihydro-3-methyl-4-(trifluoromethyl)-
CS-0282690EN300-2314511-(2,2-DIFLUOROETHYL)-3-METHYL-4-(TRIFLUOROMETHYL)-1,7-DIHYDRO-6H-PYRAZOL+1-(2,2-difluoroethyl)-3-methyl-4-(trifluoromethyl)-2H-pyrazolo[3,4-b]pyridin-6-one1-(2,2-difluoroethyl)-3-methyl-4-(trifluoromethyl)-7-hydropyrazolo[5,4-b]pyrid in-6-one
물성
구조 계산 물성
- XLogP
- 1.6
- 극성 표면적
- 46.9 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 408
물리화학적 성질
- 끓는 점
- 346.6 · 346.6±42.0 °C(Predicted)
- 밀도
- 1.62 · 1.62±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 10.48 · 10.48±0.40(Predicted)
화학 및 산업
공급사2 곳
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
南京世洲生物科技有限公司18351873721 · [email protected]
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