Diethyl benzylmalonate
- CAS NO.：607-81-8
- Empirical Formula: C14H18O4
- Molecular Weight: 250.29
- MDL number: MFCD00009166
- EINECS: 210-142-7
- SAFETY DATA SHEET (SDS)
- Update Date: 2025-01-27 09:38:02
What is Diethyl benzylmalonate?
Chemical properties
Colourless Liquid
The Uses of Diethyl benzylmalonate
Diethyl Benzylmalonate (cas# 607-81-8) is a compound useful in organic synthesis.
The Uses of Diethyl benzylmalonate
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.
Synthesis Reference(s)
The Journal of Organic Chemistry, 31, p. 620, 1966 DOI: 10.1021/jo01340a523
General Description
Diethyl benzylmalonate on condensation with 2-amino-benzimidazole yields 3-benzyl-4-hydroxypyrimido[1,2-a]benzimidazole-2-one.
Properties of Diethyl benzylmalonate
| Boiling point: | 162-163 °C/10 mmHg (lit.) |
| Density | 1.064 g/mL at 25 °C (lit.) |
| vapor pressure | 0.26Pa at 25℃ |
| refractive index | n |
| Flash point: | >230 °F |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Chloroform, Methanol |
| form | Colourless Liquid |
| pka | 12.56±0.46(Predicted) |
| color | Colorless to Almost colorless |
| Water Solubility | immiscible |
| BRN | 615793 |
| CAS DataBase Reference | 607-81-8(CAS DataBase Reference) |
| NIST Chemistry Reference | Propanedioic acid, (phenylmethyl)-, diethyl ester(607-81-8) |
| EPA Substance Registry System | Propanedioic acid, 2-(phenylmethyl)-, 1,3-diethyl ester (607-81-8) |
Safety information for Diethyl benzylmalonate
Computed Descriptors for Diethyl benzylmalonate
| InChIKey | ICZLTZWATFXDLP-UHFFFAOYSA-N |
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