Phenylmethyl 3,4-dihydro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2(1H)-isoquinolinecarboxylate
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기본 정보
- CAS
1020174-05-3- 표준 SMILES
CC1(C)OB(c2ccc3c(c2)CCN(C(=O)OCc2ccccc2)C3)OC1(C)C- InChIKey
UTVQLPVFCCVZTJ-UHFFFAOYSA-N- 분자식
- C23H28BNO4
- 평균 분자량
- 393.292 g/mol
- 단동위원소 질량
- 393.21113878
이름 및 식별자
- 우선 이름
- Phenylmethyl 3,4-dihydro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2(1H)-isoquinolinecarboxylate
- IUPAC
- Benzyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
- 영어명
- benzyl 3,4-dihydro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline-2(1H)-carboxylate
- 분자식
- C23H28BNO4
- 분자량
- 393.28
이름 및 동의어
Benzyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydroisoquinoline-2(1H)-carboxylabenzyl 3,4-dihydro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline-2(1H)-carboxylatebenzyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,3,4-tetrahydroisoquinoline-2-carboxylate6-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid benzyl ester2(1H)-Isoquinolinecarboxylic acid, 3,4-dihydro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, phenylmethyl ester
데이터베이스 식별자
- CAS
1020174-05-3- PubChem CID
- 67252180
- DTXSID
DTXSID701112154
물성
물리화학적 성질
- 끓는 점
- 530.9 · 530.9±50.0 °C(Predicted)
- 밀도
- 1.17 · 1.17±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- -1.59 · -1.59±0.20(Predicted)
관련 반응
2건
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