기본 정보
- 표준 SMILES
CN1C(=O)CCc2cc(B3OC(C)(C)C(C)(C)O3)cc(Cl)c21- InChIKey
MKYZPVTYDATXLW-UHFFFAOYSA-N- 분자식
- C16H21BClNO3
- 평균 분자량
- 321.6 g/mol
이름 및 식별자
- 우선 이름
- 8-Chloro-1-methyl-6-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-YL)-3,4-dihydro-1H-quinolin-2-one
- IUPAC
- 8-chloro-1-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydroquinolin-2-one
이름 및 동의어
1427588-44-08-CHLORO-1-METHYL-6-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-3,4-DIHYDRO-1H-QUINOLIN-2-ONEMFCD22415245(8-Chloro-1-methyl-2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)boronic acid pinacol ester8-CHLORO-1-METHYL-6-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-3,4-DIHYDROQUINOLIN-2-ONE8-Chloro-1-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydroquinolin-2(1H)-one8-chloro-1-methyl-6-(4,4,5,5-tetramethyl-[1,3,2]-dioxaborolan-2-yl)-3,4-dihydro-1H-quinolin-2-oneSCHEMBL14780336MKYZPVTYDATXLW-UHFFFAOYSA-NAKOS025290729PB377698-Chloro-1-methyl-2-oxo-1,2,3,4-tetrahydroquinoline-6-boronic Acid Pinacol Ester
이름 더 보기
AS-34147DB-400333CS-0049953F4676648-Chloro-1-methyl-3,4-dihydro-1H-quinolin-2-one-6-boronic acid pinacol ester8-Chloro-3,4-dihydro-1-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2(1H)-quinolinone
데이터베이스 식별자
- PubChem CID
- 72208046
물성
구조 계산 물성
- 극성 표면적
- 38.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 22
- 형식 전하
- 0
- 복잡도
- 454
관련 반응
4건
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