1,1-Dimethyl 2-ethenylcyclopropane-1,1-dicarboxylate

HCID 10464992CAS 17447-60-8

基本情報

標準SMILES: C=CC1CC1(C(=O)OC)C(=O)OC
InChIKey: BTHUKAQVHWDTAH-UHFFFAOYSA-N
分子式: C9H12O4
平均分子量: 184.19 g/mol
単同位体質量: 184.07355886

名称と識別子

優先名称: 1,1-Dimethyl 2-ethenylcyclopropane-1,1-dicarboxylate
IUPAC: dimethyl 2-ethenylcyclopropane-1,1-dicarboxylate
英語名: 2-Vinylcyclopropane-1,1-dicarboxylic acid dimethyl ester
分子式: C9H12O4
分子量: 184.19

名称と別名

1,1-DIMETHYL 2-ETHENYLCYCLOPROPANE-1,1-DICARBOXYLATERefChem:409941865-426-917447-60-8dimethyl 2-vinylcyclopropane-1,1-dicarboxylate2-Vinylcyclopropane-1,1-dicarboxylic acid dimethyl esterDimethyl 2-ethenylcyclopropane-1,1-dicarboxylate1,1-Cyclopropanedicarboxylic acid, 2-ethenyl-, 1,1-dimethyl esterMFCD09834582Dimethyl 2-Vinylcyclopropane-1,1-dicarboxylate;Dimethyl 3-Vinylcyclopropane-1,1-dicarboxylate1-vinyl-2,2-dicarbomethoxy cyclopropaneSCHEMBL812061

名称をさらに表示

Dimethyl 2-ethenylcyclopropane-1,1-dicarboxylate, 95%methyl 1-(methoxycarbonyl)-2-vinylcyclopropane-1-carboxylate

DTXSID60440307BTHUKAQVHWDTAH-UHFFFAOYSA-NAKOS006327686AS-71996DB-319195dimethyl-2-vinylcyclopropane-1,1-dicarboxylateEN300-176536G65540

データベース識別子

CAS: 17447-60-8
PubChem CID: 10464992
DTXSID: DTXSID60440307
EC Number: 865-426-9
Nikkaji: J452.776C

物性

構造計算による物性

XLogP: 1
極性表面積: 52.6 Å²
水素結合供与体数: 0
水素結合受容体数: 4
回転可能結合数: 5
重原子数: 13
形式電荷: 0
複雑度: 240

物理化学的性質

沸点: 72 °C · 72 °C(Press: 0.4 Torr)
比重(密度): 1.246 · 1.246±0.06 g/cm3(Predicted)
貯蔵温度: -20 °C · -20°C Freezer, Under inert atmosphere
溶解性: 酢酸エチル;ジクロロメタン;
外見: 油
色: 無色透明

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.