n-Methyl-(1-methyl-1h-pyrazol-5-yl)methylamine

Base Information

• Chemical Name: n-Methyl-(1-methyl-1h-pyrazol-5-yl)methylamine
• CAS No.: 930111-04-9
• Molecular Formula: C6H11N3
• Molecular Weight: 125.173
• Hs Code.: 2933199090
• European Community (EC) Number: 687-935-3
• DSSTox Substance ID: DTXSID20427119
• Wikidata: Q82239850
• Mol file: 930111-04-9.mol

Synonyms:930111-04-9;n-methyl-(1-methyl-1h-pyrazol-5-yl)methylamine;N-methyl-1-(1-methyl-1H-pyrazol-5-yl)methanamine;N-methyl-1-(2-methylpyrazol-3-yl)methanamine;N-Methyl(1-methyl-1H-pyrazol-5-yl)methanamine;methyl[(1-methyl-1H-pyrazol-5-yl)methyl]amine;1-Methyl-5-[(methylamino)methyl]-1H-pyrazole;Methyl-(2-methyl-2H-pyrazol-3-ylmethyl)-amine;n-methyl-n-[(1-methyl-1h-pyrazol-5-yl)methyl]amine;MFCD03419812;1-methyl-5-((methylamino)methyl)-1h-pyrazole;SCHEMBL10061627;DTXSID20427119;BBL039123;STK313027;AKOS000301634;AT14309;PS-3816;1-methyl-5-[(methylamino)methyl]pyrazole;FT-0748793;methyl (2-methyl-2h-pyrazol-3-ylmethyl)amine;EN300-190152;N-Methyl(1-Methyl-1h-pyrazol-5-yl)methanamne;methyl-(2-methyl-2 h-pyrazol-3-ylmethyl)-amine;J-523626;F2169-0788;N-Methyl-(1-methyl-1H-pyrazol-5-yl)methylamine, AldrichCPR

Chemical Property of n-Methyl-(1-methyl-1h-pyrazol-5-yl)methylamine

Chemical Property:

• Appearance/Colour: White solid
• Vapor Pressure: 0.288mmHg at 25°C
• Boiling Point: 102°C/15mm
• Flash Point: 76.4°C
• PSA: 29.85000
• Density: 1.05g/cm³
• LogP: 0.53040
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 125.095297364
• Heavy Atom Count: 9
• Complexity: 84.4

Purity/Quality:

98%min ^*data from raw suppliers

N-methyl-N-[(1-methyl-1H-pyrazol-5-yl)methyl]amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNCC1=CC=NN1C

Technology Process of n-Methyl-(1-methyl-1h-pyrazol-5-yl)methylamine

There total 2 articles about n-Methyl-(1-methyl-1h-pyrazol-5-yl)methylamine 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: 85.9%

tert-butyl ((1-methyl-1H-pyrazol-5-yl)methyl)carbamate → N-methyl-1-(1-methyl-1H-pyrazol-5-yl)methanamine (930111-04-9)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 70 ℃; for 4h;

Reference yield:

C-(2-methyl-2H-pyrazol-3-yl)methyl amine (863548-52-1) → N-methyl-1-(1-methyl-1H-pyrazol-5-yl)methanamine (930111-04-9)

Guidance literature:

Multi-step reaction with 2 steps

1: triethylamine / dichloromethane / 2 h / 0 - 20 °C

2: lithium aluminium tetrahydride / tetrahydrofuran / 4 h / 0 - 70 °C

With lithium aluminium tetrahydride; triethylamine; In tetrahydrofuran; dichloromethane;

Reference yield: 74.0%

N-methyl-1-(1-methyl-1H-pyrazol-5-yl)methanamine (930111-04-9) + rac-(4bS,5R,6R,7S,7aR)-7a-(4-bromophenyl)-4b,5-dihydroxy-4-methoxy-7-phenyl-4b,6,7,7a-tetrahydro-5H-cyclopenta[4,5]furo[2,3-c]pyridine-6-carboxylic acid → rac-(4bS,5R,6R,7S,7aR)-7a-(4-bromophenyl)-4b,5-dihydroxy-4-methoxy-N-methyl-N-((1-methyl-1H-pyrazol-5-yl)methyl)-7-phenyl-4b,6,7,7a-tetrahydro-5H-cyclopenta[4,5]furo[2,3-c]pyridine-6-carboxamide

Guidance literature:

rac-(4bS,5R,6R,7S,7aR)-7a-(4-bromophenyl)-4b,5-dihydroxy-4-methoxy-7-phenyl-4b,6,7,7a-tetrahydro-5H-cyclopenta[4,5]furo[2,3-c]pyridine-6-carboxylic acid; With N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; In N,N-dimethyl-formamide; at 0 ℃; for 0.0833333h;

N-methyl-1-(1-methyl-1H-pyrazol-5-yl)methanamine; In N,N-dimethyl-formamide; at 0 - 20 ℃; for 16h;

upstream raw materials:

C-(2-methyl-2H-pyrazol-3-yl)methyl amine

Refernces