Butyl methyl 4-nitrophenyl phosphate

Base Information

• Chemical Name: Butyl methyl 4-nitrophenyl phosphate
• CAS No.: 42893-52-7
• Molecular Formula: C₁₁H₁₆NO₆P
• Molecular Weight: 289.225
• DSSTox Substance ID: DTXSID90708200
• Mol file: 42893-52-7.mol

Synonyms:42893-52-7;Butyl methyl 4-nitrophenyl phosphate;DTXSID90708200

Chemical Property of Butyl methyl 4-nitrophenyl phosphate

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 289.07152423
• Heavy Atom Count: 19
• Complexity: 324

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCOP(=O)(OC)OC1=CC=C(C=C1)[N+](=O)[O-]

Technology Process of Butyl methyl 4-nitrophenyl phosphate

There total 3 articles about Butyl methyl 4-nitrophenyl phosphate 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:

Bis(p-nitrophenyl) phosphate (645-15-8) → Methyl-butyl-p-nitrophenyl-phosphat (42893-52-7,62682-04-6,62682-05-7)

Guidance literature:

Multi-step reaction with 3 steps

2: (alkaline hydrolysis)

DOI:10.1021/ja00790a051

Reference yield:

bis(p-nitrophenyl) methyl phosphate (799-87-1) → Methyl-butyl-p-nitrophenyl-phosphat (42893-52-7,62682-04-6,62682-05-7)

Guidance literature:

Multi-step reaction with 2 steps

1: (alkaline hydrolysis)

DOI:10.1021/ja00790a051

Reference yield:

diazobutane (764-43-2) + methyl (4-nitrophenyl)phosphate (15930-83-3) → Methyl-butyl-p-nitrophenyl-phosphat (42893-52-7,62682-04-6,62682-05-7)

Guidance literature:

DOI:10.1021/ja00790a051

upstream raw materials:

diazobutane

methyl (4-nitrophenyl)phosphate

Bis(p-nitrophenyl) phosphate

bis(p-nitrophenyl) methyl phosphate

Refernces