半岛bd体育手机客户端 说明

一般描述

Glutaconic acid, also known as 2-pentenedioic acid, is an unsaturated dicarboxylic acid. It is formed as one of the degradation products during the partial wet oxidation (PWO) of alkali lignin. The analysis of its crystal structure indicates that the compound exists predominantly in thetrans-conformation. The geometric bond lengths and bond angles of glutaconic acid have been obtained using Hartree–Fock (HF), density functional calculations and IR spectral data.

应用

Glutaconic acid has been used in the preparation of CoA-substrate glutaconyl-CoA by reacting with acetyl-CoA. It may be used in the preparation of 6-chloro-2(2H)-pyranone by reacting with phosphorus pentachloride (PCl₅).

包装

5 g in glass bottle

基本信息

线性分子式	HOOCCH2CH=CHCOOH
分子量	130.10
Beilstein	1759560
EC 号	217-027-0
MDL编号	MFCD00002784
PubChem化学物质编号	57651185
NACRES	NA.22

半岛bd体育手机客户端 性质

质量水平	100
测定	97% (T)
SMILES string	OC(=O)C\C=C\C(O)=O
InChI	1S/C5H6O4/c6-4(7)2-1-3-5(8)9/h1-2H,3H2,(H,6,7)(H,8,9)/b2-1+
InChI key	XVOUMQNXTGKGMA-OWOJBTEDSA-N

安全信息

储存分类代码	13 - Non Combustible Solids
WGK	WGK 3
闪点(F)	Not applicable
闪点(C)	Not applicable
个人防护装备	Eyeshields, Gloves, type N95 (US)