1-Dimethylamino-2-propanol

Base Information

• Chemical Name: 1-Dimethylamino-2-propanol
• CAS No.: 108-16-7
• Deprecated CAS: 53657-16-2
• Molecular Formula: C5H13NO
• Molecular Weight: 103.164
• Hs Code.: 2922.19
• European Community (EC) Number: 203-556-4
• NSC Number: 3163
• UN Number: 1993
• UNII: OX17195H4T
• DSSTox Substance ID: DTXSID5031210
• Nikkaji Number: J112.300I
• Wikidata: Q26841310
• NCI Thesaurus Code: C174816
• ChEMBL ID: CHEMBL3186209
• Mol file: 108-16-7.mol

Synonyms:1-(Dimethylamino)-2-propanol;1-Methyl-2-(dimethylamino)ethanol;2-(Dimethylamino)-1-methyl-1-ethanol;2-(Dimethylamino)-1-methylethanol;3-(Dimethylamino)-2-propanol;Bisomer Amine D 700;DL-1-(Dimethylamino)-2-propanol;Dimepranol;Dimethyl(2-hydroxypropyl)amine;Dimethylisopropanolamine;N,N-Dimethyl-2-hydroxy-1-propanamine;N,N-Dimethyl-2-hydroxypropylamine;N,N-Dimethylamino-2-propanol;N,N-Dimethylisopropanolamine;NSC 3163;

Chemical Property of 1-Dimethylamino-2-propanol

Chemical Property:

• Appearance/Colour: light yellow liquid
• Vapor Pressure: 8 mm Hg ( 20 °C)
• Melting Point: -85 °C
• Refractive Index: 1.4183 - 1.4203
• Boiling Point: 123.999 °C at 760 mmHg
• PKA: 14.95±0.20(Predicted)
• Flash Point: 25.556 °C
• PSA: 23.47000
• Density: 0.888 g/cm³
• LogP: -0.07120
• Storage Temp.: Flammables area
• Sensitive.: Air Sensitive
• Water Solubility.: miscible
• XLogP3: 0
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 103.099714038
• Heavy Atom Count: 7
• Complexity: 45.3

Purity/Quality:

99.9% ^*data from raw suppliers

Dimepranol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 10-22-34
• Safety Statements: 26-36/37/39-45-36-23

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(CN(C)C)O
• Uses: 1-Dimethylamino-2-propanol is one of the compounds used to identify the illegal manufacture of methadone.cv

Technology Process of 1-Dimethylamino-2-propanol

There total 16 articles about 1-Dimethylamino-2-propanol 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: 99.6%

dimethyl amine (124-40-3) + methyloxirane (75-56-9,16033-71-9) → 1-methyl-2-N,N-dimethylaminoethanol (108-16-7,53657-16-2)

Guidance literature:

With diisopropanolamine; at 70 ℃; for 3h; under 5250.53 Torr; Reagent/catalyst; Pressure; Temperature;

Reference yield: 98.0%

→ 1-methyl-2-N,N-dimethylaminoethanol (108-16-7,53657-16-2)

Guidance literature:

Reference yield: 60.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 3-amino-2-propanol (78-96-6,1674-56-2) → 1-methyl-2-N,N-dimethylaminoethanol (108-16-7,53657-16-2)

Guidance literature:

With formic acid; for 24h; Heating;

upstream raw materials:

1-bromo-2-propanol

dimethyl amine

1-Chloro-2-propanol

formaldehyd

Downstream raw materials:

phenyl-carbamic acid-(β-dimethylamino-isopropyl ester)

phthalic acid bis-(β-dimethylamino-isopropyl ester)

2-(dimethylamino)-1-methylethyl methacrylate

4-tert.-Butyl-benzoesaeure-<1-dimethylamino-propyl-(2)-ester>

Refernces

• 1、 Steinberg,Mednick,Rice,Maddox. "Acetylcholinesterase substrates: beta-methylcholine esters.". . p. 1107 - 1110. Retrieved 1970.
• 2、 Pelckmans, Michiel,Vermandel, Walter,Van Waes, Frederik,Moonen, Kristof,Sels, Bert F.. "Low-Temperature Reductive Aminolysis of Carbohydrates to Diamines and Aminoalcohols by Heterogeneous Catalysis". . p. 14540 - 14544. Retrieved 2017/10/23.
• 3、 Kirino, Manabu,Tomita, Ikuyoshi. "Aminimides derived from benzoylformic acid esters as thermally latent base catalysts". scheme or table. p. 8821 - 8827. Retrieved 2011/11/29.