Propanoic acid, 3-[(3,5-dinitrobenzoyl)oxy]-2-methyl-, ethyl ester, (R)-

Base Information

• Chemical Name: Propanoic acid, 3-[(3,5-dinitrobenzoyl)oxy]-2-methyl-, ethyl ester, (R)-
• CAS No.: 87884-37-5
• Molecular Formula: C₁₃H₁₄N₂O₈
• Molecular Weight: 326.263
• DSSTox Substance ID: DTXSID10538768
• Wikidata: Q82414302
• Mol file: 87884-37-5.mol

Synonyms:Propanoic acid, 3-[(3,5-dinitrobenzoyl)oxy]-2-methyl-, ethyl ester, (R)-;87884-37-5;DTXSID10538768;YDPJPKUAMFPKMR-MRVPVSSYSA-N;3-Ethoxy-2-methyl-3-oxopropyl 3,5-dinitrobenzoate #;(2R)-3-Ethoxy-2-methyl-3-oxopropyl 3,5-dinitrobenzoate

Chemical Property of Propanoic acid, 3-[(3,5-dinitrobenzoyl)oxy]-2-methyl-, ethyl ester, (R)-

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 326.07501541
• Heavy Atom Count: 23
• Complexity: 448

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(C)COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]
• Isomeric SMILES: CCOC(=O)[C@H](C)COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]

Technology Process of Propanoic acid, 3-[(3,5-dinitrobenzoyl)oxy]-2-methyl-, ethyl ester, (R)-

There total 1 articles about Propanoic acid, 3-[(3,5-dinitrobenzoyl)oxy]-2-methyl-, ethyl ester, (R)- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 40.0%

3-hydroxy-2-methyl-propionic acid ethyl ester (89534-52-1) + 3,5-dinitrobenoyl chloride (99-33-2) → 3,5-Dinitro-benzoic acid (R)-2-ethoxycarbonyl-propyl ester (87884-37-5)

Guidance literature:

With triethylamine; In diethyl ether;

upstream raw materials:

3-hydroxy-2-methyl-propionic acid ethyl ester

3,5-dinitrobenoyl chloride