CAS 80715-22-6 4-(Bromomethyl)-5-methyl-1,3-dioxol-2-one (HCID 10774141)

基本情報

CAS: 80715-22-6
標準SMILES: Cc1oc(=O)oc1CBr
InChIKey: GWFALVUXAGYMHR-UHFFFAOYSA-N
分子式: C5H5BrO3
平均分子量: 193 g/mol
単同位体質量: 191.94220612

名称と識別子

優先名称: 4-(Bromomethyl)-5-methyl-1,3-dioxol-2-one
IUPAC: 4-(bromomethyl)-5-methyl-1,3-dioxol-2-one
現地名: 4-(ブロモメチル)-5-メチル-1,3-ジオキソール-2-オン
英語名: 4-Bromomethyl-5-methyl-1,3-dioxol-2-one
分子式: C5H5BrO3
分子量: 193

名称と別名

80715-22-64-(bromomethyl)-5-methyl-1,3-dioxol-2-oneDTXSID70444679RefChem:97374DTXCID60395500807-002-84-BROMOMETHYL-5-METHYL-1,3-DIOXOL-2-ONE1,3-Dioxol-2-one, 4-(bromomethyl)-5-methyl-4-(bromomethyl)-5-methyl-2H-1,3-dioxol-2-oneMFCD077874634-Bromomethyl-5-methyl-[1,3]dioxol-2-one4-bromomethyl-5-methyl-1,3-dioxole-2-one

名称をさらに表示

4-(ブロモメチル)-5-メチル-1,3-ジオキソール-2-オン4-ブロモメチル-5-メチル-1,3-ジオキソール-2-オンDMDO-Brmdo-br4-Bromomethyl-5-methyl-14-Bromomethyl-5-methyl-1,3-dio4-methyl-5-bromo methyl-1,3-dioxol-2-one4-Bromomethyl-5-methyl-1.3-dioxolene-2-one1,3-Dioxol-2-one, 4-(bromomethyl)-5-methyl4-(Bromomethyl)-5-methyl-2-oxo-1,3-dioxole4-BROMOMETHYL-5-METHYL-1,3-DIOXOL-2-ONE 90%

C5H5BrO3SCHEMBL305702GWFALVUXAGYMHR-UHFFFAOYSA-N4-bromomethyl-5-methyl-1,3-dioxoAKOS0062849461-bromomethyl-2-methylvinylene carbonate4-bromomethyl-5-methyl-2-oxo-1,3dioxolAS-40825

データベース識別子

CAS: 80715-22-6
PubChem CID: 10774141
DTXSID: DTXSID70444679
EC Number: 807-002-8
Nikkaji: J693.555I

物性

構造計算による物性

XLogP: 1.2
極性表面積: 35.5 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: 1
重原子数: 9
形式電荷: 0
複雑度: 173

物理化学的性質

沸点: 115 · 115-120 °C(Press: 5 Torr)
比重(密度): 1.741 · 1.741±0.06 g/cm3(Predicted)
貯蔵温度: Store at Room Tem.
外見: liquid
色: Yellow
CAS データベース: 80715 · 80715-22-6(CAS DataBase Reference)

化学的性質

化学的特性Liquid

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H227 (66.7%): Combustible liquid [Warning Flammable liquids]

P210, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, 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.