Methyl 1-(((4-methyl-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridin-2-yl)oxy)methyl)cyclopropanecarboxylate
기본 정보
- CAS
1383001-34-0- 표준 SMILES
COC(=O)C1(COc2cc(C)c(B3OC(C)(C)C(C)(C)O3)cn2)CC1- InChIKey
HNWYVKWEXGWVKU-UHFFFAOYSA-N- 분자식
- C18H26BNO5
- 평균 분자량
- 347.2 g/mol
이름 및 식별자
- 우선 이름
- Methyl 1-(((4-methyl-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridin-2-yl)oxy)methyl)cyclopropanecarboxylate
- IUPAC
- methyl 1-[[4-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]oxymethyl]cyclopropane-1-carboxylate
- 영어명
- Methyl 1-(((4-Methyl-5-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)oxy)Methyl)cyclopropanecarboxylate
- 분자식
- C18H26BNO5
- 분자량
- 347.21
이름 및 동의어
1383001-34-0methyl 1-(((4-methyl-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridin-2-yl)oxy)methyl)cyclopropanecarboxylatemethyl 1-[[4-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]oxymethyl]cyclopropane-1-carboxylateSCHEMBL9936689HNWYVKWEXGWVKU-UHFFFAOYSA-NDB-109024methyl 1-({[4-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]oxy}-methyl)cyclopropanecarboxylatemethyl 1-({[4-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]oxy}methyl)cyclopropanecarboxylateMethyl 1-(((4-Methyl-5-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)oxy)Methyl)cyclopropanecarboxylateCyclopropanecarboxylic acid, 1-[[[4-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]oxy]methyl]-, methyl ester
데이터베이스 식별자
- CAS
1383001-34-0
물성
구조 계산 물성
- 극성 표면적
- 66.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 504
물리화학적 성질
- 끓는 점
- 447 · 447.0±45.0 °C(Predicted)
- 밀도
- 1.15 · 1.15±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 4.67 · 4.67±0.32(Predicted)
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…