11-Methoxy-11-oxoundecanoic acid

Base Information

• Chemical Name: 11-Methoxy-11-oxoundecanoic acid
• CAS No.: 3927-60-4
• Molecular Formula: C12H20O4
• Molecular Weight: 230.304
• Hs Code.: 2918990090
• NSC Number: 38783
• DSSTox Substance ID: DTXSID60284743
• Nikkaji Number: J122.400J
• Wikidata: Q82019839
• Mol file: 3927-60-4.mol

Synonyms:11-Methoxy-11-oxoundecanoic acid;3927-60-4;Undecanedioic acid, 1-methyl ester;Undecanedioic acid,1-methyl ester;Undecanedioic acid, monomethyl ester;11-methoxy-11-oxidanylidene-undecanoic acid;Undecanedioic acid 1-methyl ester;NSC38783;SCHEMBL879955;undecanedioic acid monomethylester;11-Methoxy-11-oxoundecanoicacid;DTXSID60284743;JAELIPKEGUQPKD-UHFFFAOYSA-N;11-keto-11-methoxy-undecanoic acid;MFCD00673464;NSC-38783;11-Methoxy-11-oxoundecanoic acid #;AKOS037645527;AS-61215;CS-0150693;FT-0656550;A824507;A828625;A1-11986

Chemical Property of 11-Methoxy-11-oxoundecanoic acid

Chemical Property:

• Vapor Pressure: 1.6E-05mmHg at 25°C
• Refractive Index: 1.455
• Boiling Point: 340.2 °C at 760 mmHg
• Flash Point: 121 °C
• PSA: 63.60000
• Density: 1.024 g/cm³
• LogP: 2.75490
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 11
• Exact Mass: 230.15180918
• Heavy Atom Count: 16
• Complexity: 201

Purity/Quality:

99.0% ^*data from raw suppliers

Undecanedioicacid,1-methylester 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CCCCCCCCCC(=O)O

Technology Process of 11-Methoxy-11-oxoundecanoic acid

There total 1 articles about 11-Methoxy-11-oxoundecanoic acid 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:

Methyl oleate (112-62-9) → sebacic acid mono methyl ester (818-88-2) + undecanedioic acid monomethyl ester (3927-60-4) + methyl 11-hydroperoxyoctadec-9-enoate (13045-55-1,26195-00-6,124915-89-5,124915-90-8,144301-52-0,54300-22-0) + methyl 8-hydroperoxyoctadec-9-enoate (13045-56-2,26194-98-9,94433-94-0) + methyl 9-hydroperoxyoctadec-10-enoate (14759-90-1,26770-47-8,116102-41-1,116181-16-9,116181-19-2,13045-58-4) + methyl 10-hydroperoxyoctadec-8-enoate (14759-91-2,26770-49-0,13045-57-3)

Guidance literature:

In glycerol; at 180 ℃;

DOI:10.1016/j.chemphyslip.2012.02.004

Reference yield: 66.57%

undecanedioic acid monomethyl ester (3927-60-4) + O-tritylhydroxylamine (31938-11-1) → C30H35NO4

Guidance literature:

undecanedioic acid monomethyl ester; O-tritylhydroxylamine; With 2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphinane-2,4,6-trioxide; triethylamine; In dichloromethane; at 20 ℃;

With lithium hydroxide monohydrate; In tetrahydrofuran; water; at 20 ℃;

DOI:10.1016/j.bmc.2018.08.008

Reference yield: 36.3%

undecanedioic acid monomethyl ester (3927-60-4) → methyl 9-decenoate (25601-41-6)

Guidance literature:

With pyridine; lead(IV) acetate; copper diacetate; In benzene; for 3h; Heating;

upstream raw materials:

Methyl oleate

Downstream raw materials:

undecanedioic acid

methyl 9-decenoate

12-Hydroxystearic acid

(12S)-12-hydroxyoctadecanoic acid