(E)-1-에톡시에텐-2-일보론산피나콜에스테르

1-Ethoxyethene-2-boronic acid pinacol ester

HCID 21973908CAS 1201905-61-4

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CCO/C=C/B1OC(C)(C)C(C)(C)O1
InChIKey: MRAYNLYCQPAZJN-BQYQJAHWSA-N
분자식: C10H19BO3
평균 분자량: 198.07 g/mol

이름 및 식별자

우선 이름: 1-Ethoxyethene-2-boronic acid pinacol ester
IUPAC: 2-[(E)-2-ethoxyethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
현지명: (E)-1-에톡시에텐-2-일보론산피나콜에스테르
영어명: (E)-1-Ethoxyethene-2-ylboronic acid pinacol ester
분자식: C10H19BO3
분자량: 198.07

이름 및 동의어

1201905-61-42-[(E)-2-ethoxyethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane1360111-87-01-Ethoxyethene-2-boronic acid pinacol ester2-((E)-2-ethoxyethenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneRefChem:432259814-906-6849-492-6(E)-2-(2-Ethoxyvinyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane(E)-1-Ethoxyethene-2-boronic acid pinacol ester2-(2-Ethoxyvinyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolanetrans-2-Ethoxyvinylboronic acid pinacol ester

이름 더 보기

(E)-1-에톡시에텐-2-일보론산피나콜에스테르7-Benzyl-2,4-dichloro-5,6...(E) -1-ethoxyvinyl-2-borate pinalol ester(E)-2-Ethoxyvinylboronic acid pinacol esterE-2-Ethoxyethenyl-1-boronic acid pinacol ester(E)-2-(2-Ethoxy-vinyl)-boronic acid picol estertrans-2-Ethoxyvinylboronic acid pinacol ester 97%

(E)-1-Ethoxyethene-2-ylboronic acid pinacol esterMFCD099988131,3,2-Dioxaborolane, 2-[(1E)-2-ethoxyethenyl]-4,4,5,5-tetramethyl-(E)-(2-ETHOXYVINYL)BORONIC ACID PINACOL ESTER2-[(E)-2-ethoxyvinyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane2-(2-ethoxyethenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneMRAYNLYCQPAZJN-BQYQJAHWSA-Ntrans-2-Ethoxyethenyl-1-boronic acid pinacol ester

데이터베이스 식별자

CAS: 1201905-61-4、1360111-87-0
PubChem CID: 21973908
EC Number: 814-906-6、849-492-6
Nikkaji: J3.618.805G

물성

구조 계산 물성

극성 표면적: 27.7 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 3
무거운 원자 수: 14
형식 전하: 0
복잡도: 207

물리화학적 성질

끓는 점: 50 ℃/0.3mm · 50℃/0.3mm
밀도: 0.935 g/mL · 0.935 g/mL at 25 °C
굴절률: 1.446 · 1.4460
인화점: 86 ℃ · 86℃
저장 조건: 2 · 2-8°C
물리적 상태: 액체
색상: Clear, colourless
InChI: InChI=1S/C10H19BO3/c1-6-12-8-7-11-13-9(2,3)10(4,5)14-11/h7-8H,6H2,1-5H3/b8-7+
InChIKey: MRAYNLYCQPAZJN-BQYQJAHWSA-N
SMILES: O1C(C)(C)C(C)(C)OB1/C=C/OCC

안전 및 규제

GHS 분류

GHS Classification · 6건

Warning

H227 (33.3%): Combustible liquid [Warning Flammable liquids]

P210, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

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

Warning

H227 (33.3%): Combustible liquid [Warning Flammable liquids]

유해성 정보

Hazard Classes and Categories · 2건

Flam. Liq. 4 (33.3%)

안전 데이터

wgk: 3
ridadr: NA 1993 / PGIII
HS 번호: 2931900090
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

응용 분야 · 1건

용도trans-2-Ethoxyvinylboronic acid pinacol ester is a boronic ester commonly used in Suzuki-Miyaura cross-coupling.This reaction is a key step to synthesize:Azaindole and diazaindoles from chloroamino-N-heterocycles.Doryanine and its derivatives from 2-bromobenzoic acid.