Dimethyl (1-oxopropyl)phosphonate

Base Information

Chemical Name:Dimethyl (1-oxopropyl)phosphonate
CAS No.:51463-65-1
Molecular Formula:C5H11 O4 P
Molecular Weight:166.114
Hs Code.:
NSC Number:169642
DSSTox Substance ID:DTXSID50305193
Nikkaji Number:J813.393J
Wikidata:Q82051689
Mol file:51463-65-1.mol

Synonyms:Dimethyl (1-oxopropyl)phosphonate;51463-65-1;NSC169642;dimethyl 1-oxopropanephosphonate;SCHEMBL2993052;DTXSID50305193;FBNFBEFWEPIJQU-UHFFFAOYSA-N;NSC-169642

Suppliers and Price of Dimethyl (1-oxopropyl)phosphonate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 6 raw suppliers

Chemical Property of Dimethyl (1-oxopropyl)phosphonate

Chemical Property:

Vapor Pressure:0.55mmHg at 25°C
Boiling Point:190.1°Cat760mmHg
Flash Point:83.1°C
Density:1.145g/cm³
XLogP3:-0.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:166.03949583
Heavy Atom Count:10
Complexity:157

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(=O)P(=O)(OC)OC

Technology Process of Dimethyl (1-oxopropyl)phosphonate

There total 2 articles about Dimethyl (1-oxopropyl)phosphonate 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: 26.0%

: 6329-53-9
(1-hydroxy-allyl)-phosphonic acid dimethyl ester

: 24743-14-4
1-allyl-3-methoxybenzene

: 51463-65-1
dimethyl 1-oxopropylphosphonate

: [(E)-1-Hydroxy-4-(3-methoxy-phenyl)-but-2-enyl]-phosphonic acid dimethyl ester

: [(E)-4-(Dimethoxy-phosphoryl)-1,4-dihydroxy-but-2-enyl]-phosphonic acid dimethyl ester

Guidance literature:: With Grubbs catalyst first generation; In dichloromethane; at 40 ℃;
DOI:10.1021/jo035795h

Reference yield:

: 96-36-6,868-85-9
methyl phosphite

: 79-03-8
propionyl chloride

: 51463-65-1
dimethyl 1-oxopropylphosphonate

Guidance literature:: Ambient temperature;
DOI:10.1080/00397919408010588

Reference yield: 89.0%

: 1295-35-8
bis(1,5-cyclooctadiene)nickel ⁽⁰⁾

: 51463-65-1
dimethyl 1-oxopropylphosphonate

: 127332-42-7
(PPh3)2Ni(η2-EtC(O)P(O)(OMe)2)

Guidance literature:: With PPh₃; In diethyl ether; N2 atmosphere; addn. of phosphonate to soln. of Ni-complex and PPh3 in Et2O, stirring (room temp., 2 h), pptn.; filtration off, washing (hexane), drying (vac.); elem. anal.;