Diethyl 2-phthalimidomalonate-2-13C

Base Information

• Chemical Name: Diethyl 2-phthalimidomalonate-2-13C
• CAS No.: 92096-47-4
• Molecular Formula: C₁₅H₁₅NO₆
• Molecular Weight: 307.269
• European Community (EC) Number: 635-605-4
• Mol file: 92096-47-4.mol

Synonyms:Diethyl 2-phthalimidomalonate-2-13C;DIETHYL2-PHTHALIMIDOMALONATE-2-13C;88596-93-4;92096-47-4;starbld0016582;SCHEMBL1332360;Diethyl 2-phthalimidomalonate-2-13C, 99 atom % 13C

Chemical Property of Diethyl 2-phthalimidomalonate-2-13C

Chemical Property:

• Melting Point: 74-76 °C(lit.)
• PSA: 89.98000
• LogP: 0.71530
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 306.09329203
• Heavy Atom Count: 22
• Complexity: 446

Purity/Quality:

ETHYL PHTHALIMIDOMALONATE-2-13C, 15N 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(C(=O)OCC)N1C(=O)C2=CC=CC=C2C1=O
• Isomeric SMILES: CCOC(=O)[13CH](C(=O)OCC)N1C(=O)C2=CC=CC=C2C1=O

Technology Process of Diethyl 2-phthalimidomalonate-2-13C

There total 1 articles about Diethyl 2-phthalimidomalonate-2-13C 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:

potassium phthalimide-15N (53510-88-6) + diethyl <2-13C>bromomalonate → diethyl <2-13C,15N>phthalimidomalonate (92096-47-4)

Guidance literature:

With cetyltributylphosphonium bromide; In toluene; at 20 ℃; for 20h;

DOI:10.1139/v94-207

upstream raw materials:

potassium phthalimide-15N

Refernces