CAS 165059-42-7 2-[(1E)-3-methoxyprop-1-en-1-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (HCID 16217443)

名称と識別子

優先名称: 2-[(1E)-3-methoxyprop-1-en-1-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
IUPAC: 2-[(E)-3-methoxyprop-1-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
現地名: TRANS-3-メトキシ-1-プロペニルボロン酸ピナコールエステル
英語名: (E)-2-(3-Methoxy-1-propen-1-yl)-4 4 5 5&
分子式: C10H19BO3
分子量: 198.07

名称と別名

165059-42-72-[(1E)-3-METHOXYPROP-1-EN-1-YL]-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE2-((1E)-3-methoxyprop-1-en-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneRefChem:447426626-097-5trans-3-Methoxy-1-propenylboronic acid pinacol ester(E)-3-METHOXY-1-PROPEN-1-YLBORONIC ACID, PINACOL ESTER(E)-2-(3-METHOXYPROP-1-EN-1-YL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANEMFCD056642972-[(E)-3-methoxyprop-1-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane2-(3-methoxyprop-1-en-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneSCHEMBL478114

名称をさらに表示

TRANS-3-メトキシ-1-プロペニルボロン酸ピナコールエステル2-(3-メトキシ-1-プロペニル)-4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン2-(3-メトキシプロパ-1-エン-1-イル)-4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン(E)-2-(3-Methoxy-1-propen-1-yl)-4 4 5 5&trans-3-Methoxy-1-propenylboronic acid pinacol ester 95%trans-3-Methoxy-1-propenylboronic acid pinacol ester, 95%

(E)-2-(3-Methoxy-1-propen-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane(E)-3-Methoxy-1-propenylboronic Acid Pinacol Ester(E)-3-Methoxy-1-propen-1-ylboronic acid,pinacol ester(E)-2-(3-methoxyprop-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneFBAOFKFCKHJXRU-VOTSOKGWSA-N(E)-2-(3-METHOXYPROPENYL)-4,4,5,5-TETRAMETHYL-(1,3,2)-DIOXABOROANE2-[(1E)-3-METHOXYPROPAKOS017343602

データベース識別子

CAS: 165059-42-7
PubChem CID: 16217443
EC Number: 626-097-5
Nikkaji: J2.359.555I、J730.121I

物性

構造計算による物性

極性表面積: 27.7 Å²
水素結合供与体数: 0
水素結合受容体数: 3
回転可能結合数: 3
重原子数: 14
形式電荷: 0
複雑度: 207

物理化学的性質

沸点: 229 · 229-230 °C(lit.)
比重(密度): 0.933 g/mL · 0.933 g/mL at 25 °C(lit.)
屈折率: 20 · n20/D 1.4430(lit.)
闪点: 214 °F · 214 °F
貯蔵温度: -20 °C, · -20°C, stored under nitrogen
InChI: 1S/C10H19BO3/c1-9(2)10(3,4)14-11(13-9)7-6-8-12-5/h6-7H,8H2,1-5H3/b7-6+
InChIKey: FBAOFKFCKHJXRU-VOTSOKGWSA-N
SMILES: COC\C=C\B1OC(C)(C)C(C)(C)O1

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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.