1,3-Propanediol, 2-(hexadecyloxy)-

Base Information

Chemical Name:1,3-Propanediol, 2-(hexadecyloxy)-
CAS No.:1931-78-8
Molecular Formula:C19H40O3
Molecular Weight:316.51900
Hs Code.:
ChEMBL ID:CHEMBL141587
DSSTox Substance ID:DTXSID80513128
Nikkaji Number:J803.492C
Wikidata:Q82372745
Mol file:1931-78-8.mol

Synonyms:1,3-Propanediol, 2-(hexadecyloxy)-;1931-78-8;2-hexadecoxypropane-1,3-diol;2-(hexadecyloxy)propane-1,3-diol;CHEMBL141587;2-O-Hexadecyl Glycerol;2-(hexadecyloxy)-1,3-Propanediol;2-hexadecylglycerol;2-O-Hexadecylglycerol;SCHEMBL2217627;DTXSID80513128;2-Hexadecyloxy-propane-1,3-diol;BDBM50121676;PD053711;CS-0006459;H-1806

Suppliers and Price of 1,3-Propanediol, 2-(hexadecyloxy)-

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

Cayman Chemical
2-O-Hexadecyl Glycerol ≥95%
10mg
$ 200.00

Cayman Chemical
2-O-Hexadecyl Glycerol ≥95%
5mg
$ 113.00

Cayman Chemical
2-O-Hexadecyl Glycerol ≥95%
1mg
$ 25.00

Cayman Chemical
2-O-Hexadecyl Glycerol ≥95%
25mg
$ 438.00

AK Scientific
1,3-Propanediol,2-(hexadecyloxy)-
10mg
$ 370.00

Total 11 raw suppliers

Chemical Property of 1,3-Propanediol, 2-(hexadecyloxy)-

Chemical Property:

Melting Point:69 °C
Boiling Point:439.7±25.0 °C(Predicted)
PKA:13.93±0.10(Predicted)
PSA：49.69000
Density:0.920±0.06 g/cm3(Predicted)
LogP:4.83750
XLogP3:6.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:18
Exact Mass:316.29774513
Heavy Atom Count:22
Complexity:193

Purity/Quality:

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

2-O-Hexadecyl Glycerol ≥95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCCCCCCCCCCOC(CO)CO
Uses 2-O-Hexadecyl Glycerol is an important research chemical where chiral-phase HPLC/MS is used to identify its alkyl group.

Technology Process of 1,3-Propanediol, 2-(hexadecyloxy)-

There total 10 articles about 1,3-Propanediol, 2-(hexadecyloxy)- 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: 91.0%

: 26524-46-9
2-O-hexadecyl-1,3-O-benzylideneglycerol

: 1931-78-8
2-O-hexadecylglycerol

Guidance literature:: With hydrogenchloride; water; In methanol; at 80 ℃; for 2h; Inert atmosphere;

Reference yield:

: 20779-14-0
methanesulfonic acid hexadecyl ester

: 1931-78-8
2-O-hexadecylglycerol

Guidance literature:: Multi-step reaction with 2 steps

1: NaH; tetrabutylammonium iodide / dimethylsulfoxide / 20 °C

2: HCl / methanol

With hydrogenchloride; tetra-(n-butyl)ammonium iodide; sodium hydride; In methanol; dimethyl sulfoxide;
DOI:10.1016/S0960-894X(02)00839-9

Reference yield:

: 36653-82-4,124-29-8
1-Hexadecanol

: 1931-78-8
2-O-hexadecylglycerol

Guidance literature:: Multi-step reaction with 3 steps

1: 76 percent / methyltriphenoxyphosphonium iodide / dimethylformamide / 0.33 h / 20 °C

2: 36 percent / Ag₂O; nBu₄NI / dimethylformamide / 6 h / 90 °C

3: 61 percent / boric acid; trimethyl borate / 0.33 h / 100 °C

With Trimethyl borate; methyltriphenoxyphosphonium iodide; boric acid; tetra-(n-butyl)ammonium iodide; silver(l) oxide; In N,N-dimethyl-formamide;
DOI:10.1248/cpb.48.903