Phenyl dihydrogen phosphate

Base Information

• Chemical Name: Phenyl dihydrogen phosphate
• CAS No.: 701-64-4
• Molecular Formula: C6H7 O4 P
• Molecular Weight: 174.093
• Hs Code.: 2931900090
• European Community (EC) Number: 211-857-7
• UNII: 75M88J863E
• DSSTox Substance ID: DTXSID6044981
• Nikkaji Number: J32.914B
• Wikidata: Q27094221
• Metabolomics Workbench ID: 52196
• ChEMBL ID: CHEMBL26128
• Mol file: 701-64-4.mol

Synonyms:phenylphosphate;phenylphosphate, dipotassium salt;phenylphosphate, disodium salt;phenylphosphate, ion (2-);phenylphosphate, monopotassium salt

Chemical Property of Phenyl dihydrogen phosphate

Chemical Property:

• Vapor Pressure: 2.1E-05mmHg at 25°C
• Melting Point: 97°C
• Boiling Point: 346.9°C at 760 mmHg
• PKA: 1.25±0.30(Predicted)
• Flash Point: 163.6°C
• PSA: 76.57000
• Density: 1.499±0.06 g/cm3(Predicted)
• LogP: 1.15810
• Solubility.: soluble in Methanol
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 174.00819570
• Heavy Atom Count: 11
• Complexity: 158

Purity/Quality:

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

Phenyl Phosphate >99.0%(T) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 34-36/38
• Safety Statements: 26-36/37/39-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OP(=O)(O)O
• Uses: Phenyl Phosphate can be used to stain membranes and other biological structures.

Technology Process of Phenyl dihydrogen phosphate

There total 35 articles about Phenyl dihydrogen 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: 100.0%

O-phenyl phosphorodichloridate (770-12-7) → phosphoric acid monophenyl ester (701-64-4)

Guidance literature:

With silver nitrate; In acetonitrile; at 0 - 5 ℃; for 1h;

Reference yield: 88.0%

di-sec-butyl phenyl phosphate (17614-09-4) → phosphoric acid monophenyl ester (701-64-4)

Guidance literature:

With Amberlite 200C; In benzene; for 48h; Product distribution; Ambient temperature;

Reference yield: 62.0%

diethyl phenylphosphonate (1754-49-0) → phosphoric acid monophenyl ester (701-64-4)

Guidance literature:

With hydrogenchloride; at 100 ℃; for 12h;

upstream raw materials:

phosphoric acid-(4-bromo-benzyl ester)-phenyl ester

dibenzyl phenylphosphate

O-phenyl phosphorodichloridate

ethyl metaphosphate

Downstream raw materials:

mannitol-1,6-bis-phosphate

D-mannitol 6-phosphate

phosphoric acid bis-(2-methoxy-ethyl ester)-phenyl ester

4-hydroxymethyl-2-oxo-2λ⁵-[1,3,2]dioxaphospholan-2-ol

Refernces

• 1、 Freeman,Colver. "-". . p. 750. Retrieved 1938.
• 2、 Esen, Cem,Incel, Anil,Mansour, Mona,Nicholls, Ian A.,Olsson, Gustaf D.,Sellergren, B?rje,Shinde, Sudhirkumar,Urraca, Javier. "Urea-Based Imprinted Polymer Hosts with Switchable Anion Preference". . p. 11404 - 11416. Retrieved 2020.
• 3、 -. "MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES". Page/Page column 59. . Retrieved 2018/06/06.