3-Propylhexanamide

Base Information

• Chemical Name: 3-Propylhexanamide
• CAS No.: 55327-20-3
• Molecular Formula: C9H19NO
• Molecular Weight: 157.2533
• DSSTox Substance ID: DTXSID30970661
• Wikidata: Q82953905
• Mol file: 55327-20-3.mol

Synonyms:3-Propylhexanamide;Hexanamide, 3-propyl-;Dipropylpropionamide;Dipropylpropionamide [French];BRN 1754327;55327-20-3;3-02-00-00829 (Beilstein Handbook Reference);3-n-Propyl-hexanamide;3-Propylhexanimidic acid;SCHEMBL4008043;DTXSID30970661;KAACLWQGBIEOGR-UHFFFAOYSA-N;LS-74992

Chemical Property of 3-Propylhexanamide

Chemical Property:

• Vapor Pressure: 0.00215mmHg at 25°C
• Boiling Point: 289.8°C at 760 mmHg
• Flash Point: 129.1°C
• Density: 0.882g/cm³
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 157.146664230
• Heavy Atom Count: 11
• Complexity: 106

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(CCC)CC(=O)N

Technology Process of 3-Propylhexanamide

There total 5 articles about 3-Propylhexanamide 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:

→ 3-Propyl-hexansaeure-amid (55327-20-3)

Guidance literature:

With ammonia;

Reference yield:

3-propyl-hexanoic acid (25110-61-6) → 3-Propyl-hexansaeure-amid (55327-20-3)

Guidance literature:

Multistep reaction; (i) (chlorination), (ii) NH₃;

Reference yield:

4-heptanone (123-19-3) → 3-Propyl-hexansaeure-amid (55327-20-3)

Guidance literature:

Multi-step reaction with 3 steps

1: (i) naphthalene, Li, THF, (ii) /BRN= 1699049/

2: (i) Ac₂O, (ii) H₂, Raney-Ni

3: (i) (chlorination), (ii) NH₃

upstream raw materials:

3-propyl-hexanoic acid

4-heptanone

3-hydroxy-3-propyl-hexanoic acid