1-Propanol, 3-propoxy-

Base Information

• Chemical Name: 1-Propanol, 3-propoxy-
• CAS No.: 4161-22-2
• Molecular Formula: C6H14O2
• Molecular Weight: 118.176
• Hs Code.: 2909499000
• European Community (EC) Number: 250-069-8
• DSSTox Substance ID: DTXSID0074346
• Nikkaji Number: J1.236.534I
• Wikidata: Q26841210
• Mol file: 4161-22-2.mol

Synonyms:3-propoxypropan-1-ol;1-Propanol, 3-propoxy-;Propoxypropanol;4161-22-2;Propasol P;Propanol, 1(or 2)-propoxy-;30136-13-1;Propylene glycol monopropyl ether;n-Propoxypropanol;1-PROPANOL,3-PROPOXY-;EINECS 250-069-8;UNII-92KA3PYX0S;Propanol, propoxy-;3-propoxy-1-propanol;92KA3PYX0S;Propanol, 1(o 2)-propoxi-;SCHEMBL223572;DTXSID0074346;AKOS005292553;LS-122654;EN300-1587412;Q26841210;Z1080358966

Chemical Property of 1-Propanol, 3-propoxy-

Chemical Property:

• PSA: 29.46000
• LogP: 0.79540
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 118.099379685
• Heavy Atom Count: 8
• Complexity: 37.5

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCOCCCO
• Use Description: 1-Propanol, 3-propoxy- is a chemical compound with potential applications in several fields. In the field of chemistry and industry, it serves as a solvent in various chemical processes and formulations, thanks to its ability to dissolve a wide range of substances. In the pharmaceutical industry, it can be used as an intermediate or reagent in the synthesis of various drugs and pharmaceutical compounds. In the cosmetic and personal care industry, it can be employed as an ingredient in skincare and haircare products due to its solubilizing properties. Additionally, 1-Propanol, 3-propoxy- may find uses in research and development, where it can act as a starting material or a building block for the synthesis of new compounds. Its versatility and compatibility with different applications make it a valuable component in these various fields.

Technology Process of 1-Propanol, 3-propoxy-

There total 7 articles about 1-Propanol, 3-propoxy- 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: 90.0%

1,3-dioxane (505-22-6) + ethylmagnesium iodide (10467-10-4) → 3-propoxypropanol (4161-22-2)

Guidance literature:

With zirconocene dichloride; In diethyl ether; for 1h; Heating;

Reference yield: 73.0%

methyl 3-propoxypropionate (14144-39-9) → 3-propoxypropanol (4161-22-2)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; for 1h; Heating;

Reference yield: 18.0%

propyl bromide (106-94-5) + trimethyleneglycol (504-63-2) → 3-propoxypropanol (4161-22-2)

Guidance literature:

With sodium hydride; In N,N-dimethyl-formamide; at 0 ℃; for 3h;

DOI:10.1021/jm070705c

upstream raw materials:

trimethylene oxide

propan-1-ol

3-propoxypropiononitrile

propyl bromide

Downstream raw materials:

3-propoxypropionaldehyde

1-bromo-3-propoxy-propane

2-(3-propoxy-propylsulfanyl)-phenol

Refernces

• 1、 -. "PRODUCTION OF HYDROXY ETHER HYDROCARBONS BY LIQUID PHASE HYDROGENOLYSIS OF CYCLIC ACETALS OR CYCLIC KETALS". Page/Page column 9. . Retrieved 2013/02/28.
• 2、 Sunagatov,Mel'nitskii,Kantor. "Reaction of Cyclic Acetals with Ethylmagnesium Iodide in the Presence of Catalytic Additives". . p. 270 - 272. Retrieved 2007/10/03.