2-Bromo-N-decylacetamide

Base Information

• Chemical Name: 2-Bromo-N-decylacetamide
• CAS No.: 5345-68-6
• Molecular Formula: C12H24 Br N O
• Molecular Weight: 278.233
• Hs Code.: 2924199090
• European Community (EC) Number: 623-766-3
• NSC Number: 1721
• UNII: TJF96MTZ7R
• DSSTox Substance ID: DTXSID20201618
• Wikidata: Q83074812
• Mol file: 5345-68-6.mol

Synonyms:N-bromoacetyl-n-decylamine

Chemical Property of 2-Bromo-N-decylacetamide

Chemical Property:

• Vapor Pressure: 1.2E-05mmHg at 25°C
• Melting Point: 41-45 °C
• Boiling Point: 369.3°Cat760mmHg
• Flash Point: 177.2°C
• PSA: 29.10000
• Density: 1.132g/cm³
• LogP: 4.02910
• Storage Temp.: 2-8°C
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 10
• Exact Mass: 277.10413
• Heavy Atom Count: 15
• Complexity: 151

Purity/Quality:

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

2-Bromo-N-decyl-acetamide 97% (GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36-36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCCCCCCCNC(=O)CBr

Technology Process of 2-Bromo-N-decylacetamide

There total 2 articles about 2-Bromo-N-decylacetamide 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: 100.0%

1-aminodecane (2016-57-1) + 2-Bromoacetyl bromide (598-21-0) → N-decyl-1-bromoethanamide (5345-68-6)

Guidance literature:

With potassium carbonate; In dichloromethane; water; at 4 - 20 ℃; for 4.5h;

DOI:10.1021/acs.jmedchem.6b01435

Reference yield:

2-bromoacetyl chloride (22118-09-8) + 1-aminodecane (2016-57-1) → N-decyl-1-bromoethanamide (5345-68-6)

Guidance literature:

With triethylamine; at 0 ℃; for 2h; Yield given;

DOI:10.1016/S0040-4039(98)00683-2

Reference yield: 97.0%

N,N'-dimethylbenzylamine (103-83-3) + N-decyl-1-bromoethanamide (5345-68-6) → C21H37N2O(1+)*Br(1-)

Guidance literature:

In acetonitrile; for 3h; Reflux;

DOI:10.1016/j.bmcl.2017.03.077

upstream raw materials:

1-aminodecane

2-Bromoacetyl bromide

2-bromoacetyl chloride

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