Pentylcyanamide

Base Information

• Chemical Name: Pentylcyanamide
• CAS No.: 32847-48-6
• Molecular Formula: C6H12N2
• Molecular Weight: 112.175
• DSSTox Substance ID: DTXSID70502425
• Nikkaji Number: J1.446.455G
• Wikidata: Q82355432
• Mol file: 32847-48-6.mol

Synonyms:Pentylcyanamide;32847-48-6;SCHEMBL173848;DTXSID70502425;AKOS011770528

Chemical Property of Pentylcyanamide

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 112.100048391
• Heavy Atom Count: 8
• Complexity: 79.8

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCNC#N

Technology Process of Pentylcyanamide

There total 1 articles about Pentylcyanamide 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: 45.0%

sodium cyanide (143-33-9,25596-52-5) + n-Pentylamine (110-58-7) → pentyl cyanamide (32847-48-6) + pentylurea (38869-91-9) + 2-(pentylamino)hexanonitrile (87888-06-0)

Guidance literature:

With sodium hydroxide; sodium persulfate; In water; at 70 ℃; for 4.5h; Product distribution;

DOI:10.1007/BF00959201

Reference yield: 87.0%

pentyl cyanamide (32847-48-6) → pentylurea (38869-91-9)

Guidance literature:

With hydrogenchloride;

Reference yield:

pentyl cyanamide (32847-48-6) → Benzylpentylcyanamide

Guidance literature:

With sodium hydroxide; Et₃NBn⁽¹⁺⁾Cl^(1-); In dichloromethane; for 1h; Heating;

DOI:10.1055/s-2000-6317

upstream raw materials:

sodium cyanide

n-Pentylamine

Downstream raw materials:

pentylurea

Methylpentylcyanamide