Laurocapram

Base Information

• Chemical Name: Laurocapram
• CAS No.: 59227-89-3
• Molecular Formula: C18H35NO
• Molecular Weight: 281.482
• Hs Code.: 29339900
• European Community (EC) Number: 261-668-9
• UNII: 1F3X9DRV9X
• DSSTox Substance ID: DTXSID0042086
• Nikkaji Number: J32.521J
• Wikidata: Q27252353
• NCI Thesaurus Code: C74344
• RXCUI: 1603852
• ChEMBL ID: CHEMBL76591
• Mol file: 59227-89-3.mol

Synonyms:1-dodecylazacycloheptan-2-one;1-dodecylhexahydro-2H-azepin-2-one;Azone;laurocapram

Chemical Property of Laurocapram

Chemical Property:

• Appearance/Colour: Colorless or yellowish transparent liquid
• Vapor Pressure: 0mmHg at 25°C
• Melting Point: -7oC
• Refractive Index: 1.47 - 1.575
• Boiling Point: 404.9 °C at 760 mmHg
• PKA: -0.43±0.20(Predicted)
• Flash Point: 165.2 °C
• PSA: 20.31000
• Density: 0.895 g/cm³
• LogP: 5.24780
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: Chloroform (Slightly), Ethanol (Slightly), Methanol (Slightly)
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 11
• Exact Mass: 281.271864740
• Heavy Atom Count: 20
• Complexity: 240

Purity/Quality:

99% ^*data from raw suppliers

Laurocapram ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCN1CCCCCC1=O
• Uses: antifungal lipopeptide Pharmaceutic aid (excipient). Laurocapram is a useful intermediate.

Technology Process of Laurocapram

There total 11 articles about Laurocapram 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: 99.6%

caprolactam (105-60-2,9012-16-2) + 1-dodecylbromide (143-15-7) → Azone (59227-89-3)

Guidance literature:

With sodium hydroxide; In water; toluene;

Reference yield: 95.2%

1-chlorododecane (112-52-7) → Azone (59227-89-3)

Guidance literature:

Reference yield: 82.3%

→ Azone (59227-89-3)

Guidance literature:

upstream raw materials:

caprolactam

1-dodecylbromide

1-dodecyl alcohol

tert-butyl methyl ether

Refernces

• 1、 Jiang,Hu,Pang,Yuan. "Syntheses of long-chain quaternary ammonium salts from fatty alcohols by microwave irradiation". . p. 847 - 850. Retrieved 2007/10/03.
• 2、 -. "N-alkyl-lactams as crystallization inhibitors". . . Retrieved 2008/06/13.