6-Oxo-undecanedioic acid

Base Information

• Chemical Name: 6-Oxo-undecanedioic acid
• CAS No.: 3242-53-3
• Molecular Formula: C₁₁H₁₈O₅
• Molecular Weight: 230.261
• Hs Code.: 2918300090
• DSSTox Substance ID: DTXSID10442795
• Wikidata: Q82260293
• Mol file: 3242-53-3.mol

Synonyms:6-Oxo-undecanedioic acid;6-oxoundecanedioic acid;3242-53-3;6-Ketohendecanedioic acid;6-keto-hendecanedioic acid;SCHEMBL7834412;DTXSID10442795

Chemical Property of 6-Oxo-undecanedioic acid

Chemical Property:

• PSA: 91.67000
• LogP: 1.84550
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 10
• Exact Mass: 230.11542367
• Heavy Atom Count: 16
• Complexity: 223

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CCC(=O)O)CC(=O)CCCCC(=O)O

Technology Process of 6-Oxo-undecanedioic acid

There total 9 articles about 6-Oxo-undecanedioic 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: 69.0%

1-(N-morpholino)cyclopent-1-ene (936-52-7) + methyl adipoyl chloride (35444-44-1) → 6-oxo-undecanedioic acid (3242-53-3)

Guidance literature:

1-(N-morpholino)cyclopent-1-ene; methyl adipoyl chloride; With triethylamine; Heating;

With hydrogenchloride; Heating;

With potassium hydroxide; at 100 ℃;

DOI:10.1016/j.bmc.2004.09.046

Reference yield:

→ 6-oxo-undecanedioic acid (3242-53-3)

Guidance literature:

With diethyl ether; triethylamine; Mehrstuendiges Kochen des Reaktionsprodukts mit KOH (10prozentig).;

Reference yield:

1-hex-5-enyl-cyclohexene → 6-oxo-undecanedioic acid (3242-53-3)

Guidance literature:

With potassium permanganate; acetone;

DOI:10.1021/ja01113a038

upstream raw materials:

2-ethoxycarbonyl-1-cyclopentanone

ethyl 4-iodobutyrate

diethyl 1,3-acetonedicarboxylate

C₁₂H₁₂O₄

Downstream raw materials:

α-5,15-<2,2'-(6-oxoundecamethylenedicarbonylamino)diphenyl>:β,β-10,20-bis(o-aminophenyl)porphyrin

C₅₅H₄₈N₄O₅

C₅₅H₄₈N₄O₅