4-(2-(Dimethylamino)ethoxy)benzeneboronic acid, pinacol ester

HCID 42598924

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 873078-93-4
표준 SMILES: CN(C)CCOc1ccc(B2OC(C)(C)C(C)(C)O2)cc1
InChIKey: JUVPIBHZWGVRFL-UHFFFAOYSA-N
분자식: C16H26BNO3
평균 분자량: 291.2 g/mol
단동위원소 질량: 291.20057409

이름 및 식별자

우선 이름: 4-(2-(Dimethylamino)ethoxy)benzeneboronic acid, pinacol ester
IUPAC: N,N-dimethyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethanamine
영어명: N,N-Dimethyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)ethanamine
분자식: C16H26BNO3
분자량: 291.19

이름 및 동의어

4-[2-(Dimethylamino)ethoxy]benzeneboronic acid, pinacol ester4-(2-(Dimethylamino)ethoxy)benzeneboronic acid, pinacol esterRefChem:512017689-104-0873078-93-4N,N-Dimethyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)ethanamineN,N-dimethyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethanamine4-(2-(Dimethylamino)ethoxy)phenylboronic acid, pinacol esterMFCD09475840SCHEMBL5856574-(2-(Dimethylamino)ethoxy)phenylboronic acid pinacol ester4-[2-(Dimethylamino)ethoxy]phenylboronic Acid Pinacol Ester

이름 더 보기

4-[2-(Dimethylamino)ethoxy]benzeneboronic acid4-[2-(Dimethylamino)ethoxy]benzeneboronicacid,pinacolester98%2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)-N,N-dimethylethanamineEthanamine, N,N-dimethyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-N,N-Dimethyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethylamine, 2-{4-[2-(Dimethylamino)ethoxy]phenyl}-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

dimethyl({2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethyl})amineN,N-dimethyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)ethan-1-amineN,N-Dimethyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethan-1-aminedimethyl-(2-[4-(4,4,5,5-tetramethyl-(1,3,2)dioxaborolan-2-yl)-phenoxy]-ethyl)-amineDimethyl-{2-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenoxy]-ethyl}-amineDTXSID20654847JUVPIBHZWGVRFL-UHFFFAOYSA-N4-(2-(Dimethylamino)ethoxy)phenylboronic acid,pinacol ester

데이터베이스 식별자

CAS: 873078-93-4
PubChem CID: 42598924
DTXSID: DTXSID20654847
EC Number: 689-104-0

물성

구조 계산 물성

극성 표면적: 30.9 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 5
무거운 원자 수: 21
형식 전하: 0
복잡도: 322

물리화학적 성질

저장 조건: 2 · 2-8°C
물리적 상태: 고체
색상: 하얀색

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (95%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.