3-(Decyloxy)-1,2-propanediol

Base Information

• Chemical Name: 3-(Decyloxy)-1,2-propanediol
• CAS No.: 10430-97-4
• Molecular Formula: C13H28 O3
• Molecular Weight: 232.36
• Hs Code.: 2909499000
• European Community (EC) Number: 600-555-4
• UNII: 4HWP80U28I
• DSSTox Substance ID: DTXSID40908910
• Nikkaji Number: J116.273J
• Wikidata: Q27259609
• Mol file: 10430-97-4.mol

Synonyms:10430-97-4;glyceryl capryl ether;3-decoxypropane-1,2-diol;3-(decyloxy)-1,2-propanediol;1,2-Propanediol, 3-decyloxy-,;1-o-decylglycerol;1,2-Propanediol, 3-decyloxy-;1,2-Propanediol, 3-(decyloxy)-;3-(DECYLOXY)PROPANE-1,2-DIOL;UNII-4HWP80U28I;3-decyloxy-1,2-propanediol;4HWP80U28I;SUNETHER MO-1;1-DECYLGLYCEROL ETHER;SCHEMBL100991;1-GLYCERYL CAPRYL ETHER;DTXSID40908910;BCP32502;(+/-)-1-O-DECYLGLYCEROL;.ALPHA.-DECYL GLYCERYL ETHER;GLYCERYL CAPRYL ETHER [INCI];3-(Decyloxy)-1,2-propanediol;1-O-decylglycerol;AI-942/40879296;Q27259609

Chemical Property of 3-(Decyloxy)-1,2-propanediol

Chemical Property:

• Vapor Pressure: 1.08E-06mmHg at 25°C
• Boiling Point: 361.7°Cat760mmHg
• Flash Point: 172.5°C
• PSA: 49.69000
• Density: 0.948g/cm³
• LogP: 2.49690
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 12
• Exact Mass: 232.20384475
• Heavy Atom Count: 16
• Complexity: 128

Purity/Quality:

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCOCC(CO)O

Technology Process of 3-(Decyloxy)-1,2-propanediol

There total 22 articles about 3-(Decyloxy)-1,2-propanediol 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: 79.0%

1-bromo dodecane (112-29-8) + (R,S)-2,2-dimethyl-1,3-dioxolane-4-methanol (100-79-8,36543-79-0) → glycerol 1-O-decylether (10430-97-4)

Guidance literature:

With tetra-(n-butyl)ammonium iodide; sodium hydride; In N,N-dimethyl-formamide; for 24h; Ambient temperature;

DOI:10.1021/jo00057a015

Reference yield: 74.0%

4-decyloxymethyl-2,2-dimethyl-[1,3]-dioxolane (191166-54-8) → glycerol 1-O-decylether (10430-97-4)

Guidance literature:

With Amberlyst(R) 15; water; In methanol; at 20 ℃; for 24h;

DOI:10.1016/j.chemphyslip.2005.03.002

Reference yield: 65.0%

decyl chloride (1002-69-3) → glycerol 1-O-decylether (10430-97-4)

Guidance literature:

With hydrogenchloride; NaH; sodium iodide; In tetrahydrofuran; ethyl acetate; N,N-dimethyl-formamide;

upstream raw materials:

methanesulfonic acid decyl ester

(R,S)-2,2-dimethyl-1,3-dioxolane-4-methanol

3-dec-1-en-t-yloxy-propane-1,2-diol

1-Decanol

Downstream raw materials:

1-Decyloxy-3-trityloxy-propan-2-ol

Acetic acid 1-decyloxymethyl-2-trityloxy-ethyl ester

1-O-decyl-2-O-hexadecanoyl-3-O-p-toluenesulfonylglycerol

1-O-decyl-3-O-tosylglycerol

Refernces

• 1、 Wood,Snyder. "". . p. 161,165. Retrieved 1967.
• 2、 Baumann,W.J.,Mangold,H.K.. "-". . p. 3055 - 3057. Retrieved 1964.
• 3、 -. "DETERGENT FOR SKIN OR HAIR". Paragraph 0038; 0040. . Retrieved 2019/08/27.
• 4、 -. "PROCESS FOR PREPARING A POLYOL ETHER". Paragraph 0123. . Retrieved 2014/02/16.