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线性分子式:
HOOCCH2CH=CHCOOH
化学文摘社编号:
分子量:
130.10
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
217-027-0
Beilstein/REAXYS Number:
1759560
MDL number:
Assay:
97% (T)
产品名称
戊烯二酸, 97% (T)
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
SMILES string
OC(=O)C\C=C\C(O)=O
assay
97% (T)
functional group
carboxylic acid
Quality Level
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Application
戊烯二酸已用于通过与乙酰基-CoA反应制备CoA-底物戊二酰基-CoA。它可用于与五氯化磷(PCl5)反应制备6-氯-2(2H)-吡喃酮。
General description
戊烯二酸又称2-戊烯二酸,是一种不饱和二羧酸。它是碱木质素部分湿法氧化(PWO) 过程中的一种降解产物。对其晶体结构的分析表明该化合物主要以反式构象存在。戊烯二酸的几何键长和键角已采用 Hartree-Fock (HF)、密度泛函计算和 IR 光谱数据获得。
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
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