2-AMINO-4-TRIFLUOROPYRIMIDINE-5-붕소산피나콜에스테르
5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-amine
기본 정보
- CAS
944401-58-5- 표준 SMILES
CC1(C)OB(c2cnc(N)nc2C(F)(F)F)OC1(C)C- InChIKey
FEVSQCNVVXXUBK-UHFFFAOYSA-N- 분자식
- C11H15BF3N3O2
- 평균 분자량
- 289.06 g/mol
- 단동위원소 질량
- 289.12094178
이름 및 식별자
- 우선 이름
- 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-amine
- IUPAC
- 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-amine
- 현지명
- 2-AMINO-4-TRIFLUOROPYRIMIDINE-5-붕소산피나콜에스테르
- 영어명
- 2-Amino-4-trifluoropyrimidine-5-boronic acid pinacol ester
- 분자식
- C11H15BF3N3O2
- 분자량
- 289.06
이름 및 동의어
944401-58-55-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-amineMFCD099520512-Amino-4-(trifluoromethyl)pyrimidine-5-boronic acid pinacol ester2-AMINO-4-TRIFLUOROPYRIMIDINE-5-BORONIC ACID PINACOL ESTERC11H15BF3N3O25-(4,4,5,5-tetramethyl(1,3,2-dioxaborolan-2-yl))-4-(trifluoromethyl)pyrimidine-2-ylamineSCHEMBL623299DTXSID10726108(2-AMINO-4-(TRIFLUOROMETHYL)PYRIMIDIN-5-YL)BORONIC ACID PINACOL ESTERAKOS015998771SB55510
이름 더 보기
2-AMINO-4-TRIFLUOROPYRIMIDINE-5-붕소산피나콜에스테르EOS-60712-4-(trifluoromethyl)2-Amino-4-trifluoromethylpyrimidine-5-boronic acid pinacol ester2-AMINO-4-TRIFLUOROPYRIMIDINE-5-BORONIC ACID PINACOL ESTER ISO 9001：2015 REACH5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-2-pyrimidinamine2-Pyrimidinamine, 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-[5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-yl]amine
2-AMINO-4-TRIFLUOROMETHYLPYRIMID5-(4455-Tetramethyl-132-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-amineDS-17282SY104524DB-358593CS-0041141F2128922-Amino-4-trifluoropyrimidine-5-boronic acid pinacol ester, 97%
데이터베이스 식별자
- CAS
944401-58-5- PubChem CID
- 57416439
- DTXSID
DTXSID10726108
물성
구조 계산 물성
- 극성 표면적
- 70.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 362
물리화학적 성질
- 끓는 점
- 403.8 · 403.8±55.0 °C(Predicted)
- 밀도
- 1.28 · 1.28±0.1 g/cm3(Predicted)
- 저장 조건
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- 산도 계수 (pKa)
- 1.8 · 1.80±0.10(Predicted)
화학 및 산업
상·하류 제품 정보
상류 원료
관련 반응
18건
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