2-(tert-부틸아미노)술포닐-페닐보론산피나콜에스테르

2-(tert-butylaMino)sulfonyl-phenylboronic acid pinacol ester

HCID 57469585

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 1260231-89-7
표준 SMILES: CC(C)(C)NS(=O)(=O)c1ccccc1B1OC(C)(C)C(C)(C)O1
InChIKey: FXHJZFAZENHBOW-UHFFFAOYSA-N
분자식: C16H26BNO4S
평균 분자량: 339.3 g/mol
단동위원소 질량: 339.16755971

이름 및 식별자

우선 이름: 2-(tert-butylaMino)sulfonyl-phenylboronic acid pinacol ester
IUPAC: N-tert-butyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamide
현지명: 2-(tert-부틸아미노)술포닐-페닐보론산피나콜에스테르
영어명: 2-(tert-butylaMino)sulfonyl-phenylboronic acid pinacol ester
분자식: C16H26BNO4S
분자량: 339.26

이름 및 동의어

1260231-89-72-(tert-butylaMino)sulfonyl-phenylboronic acid pinacol esterN-(tert-Butyl)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamideN-tert-butyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamide3-hydroxy-2,3-dimethylbutan-2-yl hydrogen (2-(N-(tert-butyl)sulfamoyl)phenyl)boronateSCHEMBL651393FXHJZFAZENHBOW-UHFFFAOYSA-NDTXSID001125510N-t-Butyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamideWS-01932DB-250782D86834

이름 더 보기

2-(tert-부틸아미노)술포닐-페닐보론산피나콜에스테르2-(tert-butylaMino)sulfonyl-phenylboronic acid picol esterBenzenesulfonamide, N-(1,1-dimethylethyl)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-

N-(1,1-Dimethylethyl)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamideN-t-butyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-benzenesulfonamideN-t-butyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene sulfonamideN-tert-Butyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene-1-sulfonamide

데이터베이스 식별자

CAS: 1260231-89-7
PubChem CID: 57469585
DTXSID: DTXSID001125510

물성

구조 계산 물성

극성 표면적: 73 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 5
회전 가능 결합 수: 4
무거운 원자 수: 23
형식 전하: 0
복잡도: 517

물리화학적 성질

물리적 상태: solid
InChI: 1S/C16H26BNO4S/c1-14(2,3)18-23(19,20)13-11-9-8-10-12(13)17-21-15(4,5)16(6,7)22-17/h8-11,18H,1-7H3
InChIKey: FXHJZFAZENHBOW-UHFFFAOYSA-N
SMILES: CC1(C)C(C)(C)OB(C2=CC=CC=C2S(=O)(NC(C)(C)C)=O)O1