1,3-Dimethylpentylamine

Base Information

• Chemical Name: 1,3-Dimethylpentylamine
• CAS No.: 105-41-9
• Molecular Formula: C7H17N
• Molecular Weight: 115.219
• Hs Code.: 2921199090
• European Community (EC) Number: 203-296-1
• NSC Number: 1106
• UNII: X49C572YQO
• DSSTox Substance ID: DTXSID60861715
• Nikkaji Number: J5.043A
• Wikipedia: Methylhexanamine
• Wikidata: Q2594649
• Mol file: 105-41-9.mol

Synonyms:4-methyl-2-hexylamine;methylhexaneamine

Chemical Property of 1,3-Dimethylpentylamine

Chemical Property:

• Appearance/Colour: white or category of white crystal powder
• Vapor Pressure: 0.651mmHg at 25°C
• Melting Point: 120-130 °C
• Refractive Index: n20/D1.417-1.419
• Boiling Point: 133.9 °C at 760 mmHg
• PKA: pKa 10.54(H2O,t =24±1,I=0.002) (Uncertain)
• Flash Point: 28.9 °C
• PSA: 26.02000
• Density: 0.775 g/cm³
• LogP: 2.47010
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 115.136099547
• Heavy Atom Count: 8
• Complexity: 52.3

Purity/Quality:

1,3-Dimethylamylamine analytical standard ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 10-22-34
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)CC(C)N
• Description: 1,3-dimethylamylamine or methylexaneamine (DMAA) is a synthetic pharmaceutical patented in the 1940s as a nasal decongestant which can be used as a recreational stimulant. Alleged to occur in nature，DMAA has become a widely used ingredient in sports food supplements, despite its status as a doping agent and concerns over its safety. The most popular brands containing DMAA include Jack3d? and OxyElite Pro?, both marketed by USP Labs and both detained by the FDA in July 2013 (however, some can still be found on Amazon and other online retail stores).
• Uses: DMAA (1,3-dimethylamylamine) is an amphetamine derivative that has been widely used in sports supplements sold in the United States. Also known as methylhexanamine or geranium extract, DMAA is often touted as a "natural" stimulant, with many claimed functional uses including a body-building aid, an athletic performance enhancer, and a weight-loss aid. Although DMAA at one time was approved as a drug for nasal decongestion, no medical use of DMAA is recognized today. FDA is not aware of any reliable science indicating that DMAA exists naturally in plants.
• Therapeutic Function: Nasal decongestant

Technology Process of 1,3-Dimethylpentylamine

There total 2 articles about 1,3-Dimethylpentylamine 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:

4-methylhexan-2-one (105-42-0) → 1,3-dimethylamylamine (105-41-9)

Guidance literature:

Reference yield:

→ 1,3-dimethylamylamine (105-41-9)

Guidance literature:

With ethanol; sodium; toluene;

Reference yield: 21.0%

octanol (111-87-5) + 1,3-dimethylamylamine (105-41-9) + cuminol (536-60-7) → C25H45N

Guidance literature:

With Cu₂Al₃Ox-HT; In toluene; at 160 ℃; for 24h; Sealed tube; Inert atmosphere;

DOI:10.1039/c5cc02205c

upstream raw materials:

4-methylhexan-2-one