tert-Butyl 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,4,5-tetrahydro-3H-benzo[d]azepine-3-carboxylate

HCID 57505869

기본 정보

표준 SMILES
CC(C)(C)OC(=O)N1CCc2ccc(B3OC(C)(C)C(C)(C)O3)cc2CC1
InChIKey
LLOANUGXWMHGAZ-UHFFFAOYSA-N
분자식
C21H32BNO4
평균 분자량
373.3 g/mol

이름 및 식별자

우선 이름
tert-Butyl 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,4,5-tetrahydro-3H-benzo[d]azepine-3-carboxylate
IUPAC
tert-butyl 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate

이름 및 동의어

720692-76-2tert-Butyl 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,4,5-tetrahydro-3H-benzo[d]azepine-3-carboxylatetert-butyl 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate3H-3-BENZAZEPINE-3-CARBOXYLIC ACID, 1,2,4,5-TETRAHYDRO-7-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-, 1,1-DIMETHYLETHYL ESTERSCHEMBL2118099LLOANUGXWMHGAZ-UHFFFAOYSA-NDB-096861CS-0119861E790241,1-Dimethylethyl 7-(4,4,5,5-tetramethyl--1,3,2-dioxaborolan-2-yl)-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carboxylate1,1-dimethylethyl 7-(4,4,5,5-tetramethyl-1,3,2-d ioxaborolan-2-yl)-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carboxylate1,1-Dimethylethyl 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carboxylate
이름 더 보기
TERT-BUTYL 1,2,4,5-TETRAHYDRO-7-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZO[D]AZEPINE-3-CARBOXYLATE

데이터베이스 식별자

PubChem CID
57505869

물성

구조 계산 물성

극성 표면적
48 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
3
무거운 원자 수
27

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8건

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