1,3-Propanediol, 2-cyclohexyl-2-(hydroxymethyl)-, cyclic phosphate (1:1)

Base Information

Chemical Name:1,3-Propanediol, 2-cyclohexyl-2-(hydroxymethyl)-, cyclic phosphate (1:1)
CAS No.:67590-50-5
Molecular Formula:C₁₀H₁₇O₄P
Molecular Weight:232.216
Hs Code.:
DSSTox Substance ID:DTXSID70217906
Wikidata:Q83094606

Synonyms:BRN 2274647;1,3-Propanediol, 2-cyclohexyl-2-(hydroxymethyl)-, cyclic phosphate (1:1);2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octan-1-one, 4-cyclohexyl-;4-Cyclohexyl-2,6,7-trioxa-1-phosphabicyclo(2.2.2)octan-1-one;2-Cyclohexyl-2-(hydroxymethyl)-1,3-propanediol, cyclic phosphate (1:1);67590-50-5;SCHEMBL813291;C10H17O4P;DTXSID70217906;C10-H17-O4-P;LS-120304;2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane, 4-cyclohexyl-, 1-oxide

Suppliers and Price of 1,3-Propanediol, 2-cyclohexyl-2-(hydroxymethyl)-, cyclic phosphate (1:1)

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 2 raw suppliers

Chemical Property of 1,3-Propanediol, 2-cyclohexyl-2-(hydroxymethyl)-, cyclic phosphate (1:1)

Chemical Property:

Vapor Pressure:0.00193mmHg at 25°C
Boiling Point:301°C at 760 mmHg
Flash Point:149.7°C
Density:1.26g/cm³
XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:232.08644602
Heavy Atom Count:15
Complexity:267

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC(CC1)C23COP(=O)(OC2)OC3

Technology Process of 1,3-Propanediol, 2-cyclohexyl-2-(hydroxymethyl)-, cyclic phosphate (1:1)

There total 5 articles about 1,3-Propanediol, 2-cyclohexyl-2-(hydroxymethyl)-, cyclic phosphate (1:1) 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: 30.0%

: 67590-30-1
2-cyclohexyl-2-hydroxymethylpropan-1,3-diol

: 67590-50-5
4-Cyclohexyl-2,6,7-trioxa-1-phospha-bicyclo[2.2.2]octane 1-oxide

Guidance literature:: With pyridine; trichlorophosphate; In acetonitrile;
DOI:10.1271/bbb1961.46.411

Reference yield:

: 5664-21-1
cyclohexylacetaldehyde

: 67590-50-5
4-Cyclohexyl-2,6,7-trioxa-1-phospha-bicyclo[2.2.2]octane 1-oxide

Guidance literature:: Multi-step reaction with 2 steps

1: NaOH / H₂O / 1 h / 50 °C

2: POCl₃ / 20 - 70 °C

With sodium hydroxide; trichlorophosphate; In water;

Reference yield:

: 108-85-0
1-bromocyclohexane

: 67590-50-5
4-Cyclohexyl-2,6,7-trioxa-1-phospha-bicyclo[2.2.2]octane 1-oxide

Guidance literature:: Multi-step reaction with 4 steps

2: 79 percent / K₂CO₃ / dimethylsulfoxide / 168 h / Ambient temperature

3: 28 percent / LiAlH₄ / diethyl ether / Ambient temperature

4: 30 percent / POCl₃, pyridine / acetonitrile

With pyridine; lithium aluminium tetrahydride; potassium carbonate; trichlorophosphate; In diethyl ether; dimethyl sulfoxide; acetonitrile;
DOI:10.1271/bbb1961.46.411