1,3-PROPANE-2,2-D2-DIOL

Base Information

• Chemical Name: 1,3-PROPANE-2,2-D2-DIOL
• CAS No.: 38645-14-6
• Molecular Formula: HOCH2CD2CH2OH
• Molecular Weight: 78.11
• Mol file: 38645-14-6.mol

Synonyms:Propane-2,2-d2;propane-1,3-diol-2,2-d2;1,3-propanediol-2,2-d2;2,2-Dideuterio-propan;1,3-propanediol-2-d2;CH3CD2CH3;2,2-dideuterio-propane;2,2-dideuteriopropane-1,3-diol;

Chemical Property of 1,3-PROPANE-2,2-D2-DIOL

Chemical Property:

• PSA: 40.46000
• LogP: -0.63890

Purity/Quality:

1,3-Propane-2,2-d2-diol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: 1,3-Propane-2,2-d2-diol (CAS# 38645-14-6) is a useful isotopically labeled research compound.

Technology Process of 1,3-PROPANE-2,2-D2-DIOL

There total 5 articles about 1,3-PROPANE-2,2-D2-DIOL 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: 78.0%

diethyl [2H2]malonate (4303-49-5) → <2,2-2H2>propane-1,3-diol (38645-14-6)

Guidance literature:

diethyl [²H₂]malonate; With lithium aluminium tetrahydride; In diethyl ether; at 0 ℃; Reflux;

With water; sodium hydroxide; In diethyl ether; for 4h;

DOI:10.1002/ejoc.201100188

Reference yield:

diethyl malonate (105-53-3) → C3H7(2)HO2 + <2,2-2H2>propane-1,3-diol (38645-14-6)

Guidance literature:

diethyl malonate; With water-d2; tetra-(n-butyl)ammonium iodide; potassium carbonate;

With lithium aluminium tetrahydride; In diethyl ether; for 6h; Title compound not separated from byproducts; Heating;

DOI:10.1021/ol052456x

Reference yield:

2,2-dideuterio-malonic acid dimethyl ester (36647-07-1) → <2,2-2H2>propane-1,3-diol (38645-14-6)

Guidance literature:

Yield given. Multistep reaction;

DOI:10.1021/ja00331a038

upstream raw materials:

d₂-malonic acid

diethyl [²H₂]malonate

2,2-dideuterio-malonic acid dimethyl ester

diethyl malonate

Downstream raw materials:

3-(4-nitrophenoxy)-1-(2,2-2H₂)propanediol

[2,2-⁽²⁾H₂]-3-(benzyloxy)-1-propanol