기본 정보
- CAS
1153950-01-6- 표준 SMILES
CC1(C)OB(c2cnn(C3(CC#N)CC(C#N)C3)c2)OC1(C)C- InChIKey
GYCVKTQPTBPWJP-UHFFFAOYSA-N- 분자식
- C16H21BN4O2
- 평균 분자량
- 312.2 g/mol
- 단동위원소 질량
- 312.1757561
이름 및 식별자
- 우선 이름
- 3-(Cyanomethyl)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)cyclobutane-1-carbonitrile
- IUPAC
- 3-(cyanomethyl)-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]cyclobutane-1-carbonitrile
- 영어명
- Cyclobutaneacetonitrile, 3-cyano-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]-
- 분자식
- C16H21BN4O2
- 분자량
- 312.17
이름 및 동의어
2127110-50-13-(Cyanomethyl)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)cyclobutane-1-carbonitrile1153950-01-6Rel-(1R,3R)-3-(cyanomethyl)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)cyclobutane-1-carbonitrile(1R,3R)-3-(CYANOMETHYL)-3-(4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOL-1-YL)CYCLOBUTANE-1-CARBONITRILE3-(cyanomethyl)-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]cyclobutane-1-carbonitrileSCHEMBL3713771SCHEMBL19253503SCHEMBL19271758GYCVKTQPTBPWJP-UHFFFAOYSA-Ntrans-3-(cyanomethyl)-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]cyclobutanecarbonitrileCS-0135520
이름 더 보기
Cyclobutaneacetonitrile, 3-cyano-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]-
E726673-(cyanomethyl)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)cyclobutanecarbonitrile
데이터베이스 식별자
- CAS
1153950-01-6- PubChem CID
- 68756362
물성
구조 계산 물성
- 극성 표면적
- 83.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 23
- 형식 전하
- 0
- 복잡도
- 565
화학 및 산업
공급사4 곳
济南尚博医药股份有限公司0531-61320525 15866703830 · [email protected]
济南尚博生物科技有限公司+8615866703830 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
南京沃格尼化工有限公司15996452985 · [email protected]
관련 반응
2건
화합물 노트
불러오는 중…