CAS 33670-32-5 (Methoxymethyl)triphenylphosphonium bromide (HCID 2773654)

基本情報

CAS: 33670-32-5
標準SMILES: COC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
InChIKey: NOCGROPYCGRERZ-UHFFFAOYSA-M
分子式: C20H20BrOP
平均分子量: 387.2 g/mol
単同位体質量: 386.04351

名称と識別子

優先名称: (Methoxymethyl)triphenylphosphonium bromide
IUPAC: methoxymethyl(triphenyl)phosphanium bromide
英語名: (Methoxymethyl)triphenylphosphonium bromide
分子式: C20H20BrOP
分子量: 387.25

名称と別名

(Methoxymethyl)triphenylphosphonium bromide33670-32-5DTXSID60378616RefChem:210588DTXCID60329643MFCD00075442C20H20BrOPmethoxymethyl(triphenyl)phosphanium;bromidePhosphonium, (methoxymethyl)triphenyl-, bromideAKOS005256325CS-W006206(methoxymethyl) triphenylphosphonium bromide

名称をさらに表示

(methoxymethyl)triphenylphosphanium bromideTriphenyl(methoxymethyl)phosphonium bromide(Methoxymethyl)tris(phenyl)phosphonium bromide(Methoxymethyl)(triphenyl)phosphonium bromide 98%(methoxymethyl)triphenyl-Phosphonium bromide (1:1)PhosphoniuM,(MethoxyMethyl)triphenyl-, broMide (1:1)(Methoxymethyl)triphenylphosphonium bromide, tech. 90 % (31P NMR)

PHOSPHAZENEBASEP1-T-BUMethoxymethyl)triphenylphosphonium bromide(methoxymethyl)triphenylphoSCHEMBL595357NOCGROPYCGRERZ-UHFFFAOYSA-Mmethoxymethyltriphenylphosphonium bromidemethoxymethyl triphenylphosphonium bromidemethoxymethyl(triphenyl)phosphonium;bromide

データベース識別子

CAS: 33670-32-5
PubChem CID: 2773654
DTXSID: DTXSID60378616
EC Number: 687-307-9

物性

構造計算による物性

極性表面積: 9.2 Å²
水素結合供与体数: 0
水素結合受容体数: 2
回転可能結合数: 5
重原子数: 23
形式電荷: 0
複雑度: 266

物理化学的性質

融点: 175 · 175-179 °C
貯蔵温度: Inert atmosphere,Room Temperature
外見: solid
色: White to off-white
InChI: InChI=1S/C20H20OP.BrH/c1-21-17-22(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20;/h2-16H,17H2,1H3;1H/q+1;/p-1
InChIKey: NOCGROPYCGRERZ-UHFFFAOYSA-M
SMILES: [P+](COC)(C1C=CC=CC=1)(C1C=CC=CC=1)C1=CC=CC=C1.[Br-]

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (100%): 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 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.