Diphosphoramide, N,N',N'',N'''-tetrakis(1-methylethyl)-

Base Information

• Chemical Name: Diphosphoramide, N,N',N'',N'''-tetrakis(1-methylethyl)-
• CAS No.: 513-00-8
• Molecular Formula: C12H32 N4 O3 P2
• Molecular Weight: 342.359
• European Community (EC) Number: 208-149-5
• DSSTox Substance ID: DTXSID00965589
• Nikkaji Number: J10.341A
• Wikidata: Q82947849
• Pharos Ligand ID: V1FLMTNRY5U3
• ChEMBL ID: CHEMBL494887
• Mol file: 513-00-8.mol

Synonyms:Iso OMPA;Iso-OMPA;Tetraisopropylpyrophosphamide

Chemical Property of Diphosphoramide, N,N',N'',N'''-tetrakis(1-methylethyl)-

Chemical Property:

• Vapor Pressure: 1.67E-06mmHg at 25°C
• Melting Point: 151 °C(Solv: acetone (67-64-1))
• Boiling Point: 396.7°Cat760mmHg
• PKA: 1.22±0.70(Predicted)
• Flash Point: 193.7°C
• PSA: 111.11000
• Density: 1.076g/cm³
• LogP: 4.77480
• Storage Temp.: −20°C
• XLogP3: 1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 10
• Exact Mass: 342.19496489
• Heavy Atom Count: 21
• Complexity: 336

Purity/Quality:

98%,99%, ^*data from raw suppliers

Tetraisopropyl pyrophosphoramide butyrylcholinesterase inhibitor ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T+
• Hazard Codes: T+
• Statements: 26/27/28
• Safety Statements: 22-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(C)NP(=O)(NC(C)C)OP(=O)(NC(C)C)NC(C)C
• Uses: Tetraisopropyl pyrophosphoramide has been used:as a butyrylcholinesterase inhibitor to determine the proportions of butyrylcholinesterase (BChE) in cat and tiger plasmato inhibit wild-type BChE in acetylcholinesterase assayto selectively block the enzymatic activity of AChE

Technology Process of Diphosphoramide, N,N',N'',N'''-tetrakis(1-methylethyl)-

There total 1 articles about Diphosphoramide, N,N',N'',N'''-tetrakis(1-methylethyl)- 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:

isopropylamine (75-31-0) → tetraisopropyl pyrophosphoramide (513-00-8)

Guidance literature:

With chloroform; trichlorophosphate; und Erhitzen des Reaktionsprodukts mit N,N'-Diisopropyl-diamidophosphorsaeure-aethylester bis auf 130grad;

upstream raw materials:

isopropylamine