Pentanoic acid, 2-ethyl-2-propyl-

Base Information

• Chemical Name: Pentanoic acid, 2-ethyl-2-propyl-
• CAS No.: 62179-62-8
• Molecular Formula: C10H20O2
• Molecular Weight: 172.26500
• DSSTox Substance ID: DTXSID10432757
• Wikidata: Q82246865
• Mol file: 62179-62-8.mol

Synonyms:Pentanoic acid, 2-ethyl-2-propyl-;62179-62-8;dipropyl butanoic acid;SCHEMBL2200625;DTXSID10432757

Chemical Property of Pentanoic acid, 2-ethyl-2-propyl-

Chemical Property:

• Boiling Point: 132 °C(Press: 22 Torr)
• PKA: 4.85±0.40(Predicted)
• PSA: 37.30000
• Density: 0.914±0.06 g/cm3(Predicted)
• LogP: 3.06760
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 172.146329876
• Heavy Atom Count: 12
• Complexity: 135

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(CC)(CCC)C(=O)O

Technology Process of Pentanoic acid, 2-ethyl-2-propyl-

There total 3 articles about Pentanoic acid, 2-ethyl-2-propyl- 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:

valproic acid (99-66-1) → 2-ethyl-2-propyl-valeric acid (62179-62-8)

Guidance literature:

Reference yield:

2-ethyl-1-phenyl-2-propyl-pentan-1-one (854659-26-0) → 2-ethyl-2-propyl-valeric acid (62179-62-8)

Guidance literature:

With sodium amide; benzene; Behandeln des entstandenen Amids mit konz.NaNO₂-Loesung und H₂SO₄ unter starker Kuehlung;

Reference yield:

2-ethyl-1-phenyl-2-propyl-pentan-1-one (854659-26-0) + sodium amide + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → 2-ethyl-2-propyl-valeric acid (62179-62-8)

Guidance literature:

Behandeln mit Schwefelsaeure und wss. NaNO₂-Loesung unter Kuehlung;

upstream raw materials:

2-ethyl-1-phenyl-2-propyl-pentan-1-one

benzene

valproic acid

Refernces