11-Bromo-N-butyl-N-methylundecanamide

Base Information

• Chemical Name: 11-Bromo-N-butyl-N-methylundecanamide
• CAS No.: 155142-81-7
• Molecular Formula: C₁₆H₃₂BrNO
• Molecular Weight: 334.34
• DSSTox Substance ID: DTXSID40701145
• Wikidata: Q82632744
• Mol file: 155142-81-7.mol

Synonyms:11-BROMO-N-BUTYL-N-METHYLUNDECANAMIDE;155142-81-7;N-METHYL-N-BUTYL-11-BROMO-UNDECANAMIDE;SCHEMBL5523275;DTXSID40701145;ZRFPEJFTRMIWQF-UHFFFAOYSA-N;11-Bromo-undecanoic acid n-butyl-methyl-amide

Chemical Property of 11-Bromo-N-butyl-N-methylundecanamide

Chemical Property:

• PSA: 20.31000
• LogP: 5.15070
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 13
• Exact Mass: 333.16673
• Heavy Atom Count: 19
• Complexity: 209

Purity/Quality:

99% ^*data from raw suppliers

N-METHYL-N-BUTYL-11-BROMO-UNDECANAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCN(C)C(=O)CCCCCCCCCCBr

Technology Process of 11-Bromo-N-butyl-N-methylundecanamide

There total 3 articles about 11-Bromo-N-butyl-N-methylundecanamide 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: 82.0%

N-n-butyl-N-methylamine (110-68-9) + 11-bromoundecanoic acid (2834-05-1) → 11-bromo-N-butyl-N-methylundecanamide (155142-81-7)

Guidance literature:

With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; for 3h;

Reference yield:

11-bromoundecanoic acid (2834-05-1) → 11-bromo-N-butyl-N-methylundecanamide (155142-81-7)

Guidance literature:

Multi-step reaction with 2 steps

1: Bu₃N / CH₂Cl₂ / 0.67 h / -10 °C

2: CH₂Cl₂ / 3 h

With tributyl-amine; In dichloromethane;

DOI:10.1021/jm00034a009

Reference yield:

N-n-butyl-N-methylamine (110-68-9) + C16H29BrO4 → 11-bromo-N-butyl-N-methylundecanamide (155142-81-7)

Guidance literature:

In dichloromethane; for 3h; Yield given;

DOI:10.1021/jm00034a009

upstream raw materials:

N-n-butyl-N-methylamine

11-bromoundecanoic acid

Downstream raw materials:

11-(3,17β-dihydroxy-estra-1,3,5(10)-triene-7α-yl)-undecanoic acid n-butyl-methyl-amide

N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide