135542
苄基丙二酸二乙酯
98%
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线性分子式:
C6H5CH2CH(CO2C2H5)2
化学文摘社编号:
分子量:
250.29
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
210-142-7
Beilstein/REAXYS Number:
615793
MDL number:
产品名称
苄基丙二酸二乙酯, 98%
InChI key
ICZLTZWATFXDLP-UHFFFAOYSA-N
InChI
1S/C14H18O4/c1-3-17-13(15)12(14(16)18-4-2)10-11-8-6-5-7-9-11/h5-9,12H,3-4,10H2,1-2H3
SMILES string
CCOC(=O)C(Cc1ccccc1)C(=O)OCC
assay
98%
refractive index
n20/D 1.486 (lit.)
bp
162-163 °C/10 mmHg (lit.)
density
1.064 g/mL at 25 °C (lit.)
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Application
Diethyl benzylmalonate was used in the synthesis of macrocyclic ligands and determination of stability constants of their Cu(II), Ni(II) and Co(II) complexes. It was used as starting reagent for the synthesis of 2-benzyl-1,3-propane diol.
General description
Diethyl benzylmalonate on condensation with 2-amino-benzimidazole yields 3-benzyl-4-hydroxypyrimido[1,2-a]benzimidazole-2-one.
hcodes
pcodes
Hazard Classifications
Aquatic Chronic 2
存储类别
10 - Combustible liquids
wgk
WGK 3
flash_point_f
235.4 °F - closed cup
flash_point_c
113 °C - closed cup
ppe
Eyeshields, Gloves
Hui Tian et al.
Dalton transactions (Cambridge, England : 2003), 47(3), 675-683 (2017-12-23)
A visible light induced three-component catalytic system with the cobalamin derivative (B
Dioxygen adducts of nickel (II) and cobalt (II) dioxopentaazamacrocyclic complexes: Kinetics, stabilities, and hydroxylation of the ligands in the nickel dioxygen complexes.
Chen D, et al.
Inorganic Chemistry, 30(6), 1396-1402 (1991)
A Kreutzberger et al.
Arzneimittel-Forschung, 33(11), 1517-1518 (1983-01-01)
Within the structural class of pyrimidol[1,2-a]benzimidazole-2,4-diones accessible through condensation of 2-amino-benzimidazole (1) with malonates (2) there occur representatives exhibiting centrally dampening properties. In particular, aromatic moieties have now been included into the present investigations. By condensation of 1 with diethyl
Jonathan R LaRochelle et al.
Bioorganic & medicinal chemistry, 25(24), 6479-6485 (2017-11-02)
The PTPN11 oncogene encodes the cytoplasmic protein tyrosine phosphatase SHP2, which, through its role in multiple signaling pathways, promotes the progression of hematological malignancies and other cancers. Here, we employ high-throughput screening to discover a lead chemical scaffold, the benzothiazolopyrimidones
Enzymatic asymmetrization of prochiral 2-benzyl-1, 3-propanediol through esterification in solvent media.
Ducret A, et al.
Biotechnology Letters, 22(8), 709-713 (2000)
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