99282-16-3

Basic information

• Product Name: 3-(fluoromethyl)-3-butenyl diphosphate
• Synonyms: 3-(fluoromethyl)-3-butenyl diphosphate
• CAS NO: 99282-16-3
• Molecular Formula: C5H11 F O7 P2
• Molecular Weight: 0
• Mol File: 99282-16-3.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 455.2°Cat760mmHg
• Flash Point: 229.1°C
• Appearance: /
• Density: 1.6g/cm³
• Vapor Pressure: 1.49E-09mmHg at 25°C
• Refractive Index: 1.479
• CAS DataBase Reference: 3-(fluoromethyl)-3-butenyl diphosphate(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(fluoromethyl)-3-butenyl diphosphate(99282-16-3)
• EPA Substance Registry System: 3-(fluoromethyl)-3-butenyl diphosphate(99282-16-3)

Safety Data

• Hazardous Substances Data: 99282-16-3(Hazardous Substances Data)

Usage

InChI:InChI=1/C5H11FO7P2/c1-5(4-6)2-3-12-15(10,11)13-14(7,8)9/h1-4H2,(H,10,11)(H2,7,8,9)

Upstream product

• 76947-02-9 tris(tetra-n-butylammonium) hydrogen pyrophosphate 
• 104715-26-6 3(fluoromethyl)-3-buten-1-ol 

Relevant articles and documents

Phosphorylation of Isoprenoid Alcohols

Procedures for the synthesis and purification of 20 isoprenoid diphosphates and methanediphosphonate analogues from the corresponding alcohols are described.The alcohols are activated for phosphorylation by conversion of homoallylic systems to tosylates and allylic systems to halides.The activated intermediates are treated with tris(tetra-n-butylammonium) salts of pyrophosphoric, methanediphosphonic, or difluoromethanediphosphonic acid to obtain the corresponding esters in yields 34-80percent.Chromatography on cellulose is a general method for purification of isoprenoid diphosphates, and procedures are decribed for compounds with C5 to C20 hydrocarbon moieties.The displacement by pyrophosphate occurs with inversion of configuration, and the procedure can be used to prepare isoprenoid diphosphates with chiral C1 methylene groups in high optical purity from the corresponding alcohols.