3-methyl-1-propyl-1H-pyrazol-5-amine

Base Information

• Chemical Name: 3-methyl-1-propyl-1H-pyrazol-5-amine
• CAS No.: 3524-34-3
• Molecular Formula: C₇H₁₃N₃
• Molecular Weight: 139.2
• Hs Code.: 2933199090
• DSSTox Substance ID: DTXSID00360252
• Wikidata: Q82141893
• Mol file: 3524-34-3.mol

Synonyms:5-Methyl-2-propyl-2H-pyrazol-3-ylamine;3524-34-3;3-methyl-1-propyl-1H-pyrazol-5-amine;5-methyl-2-propylpyrazol-3-amine;SCHEMBL691318;DTXSID00360252;HMS1704K04;AM9889;MFCD05237221;STK348636;AKOS000302994;BS-27989;5-methyl-2-propyl-2 h-pyrazol-3-ylamine;CS-0451562;FT-0677318;A874687;5-Methyl-2-propyl-2H-pyrazol-3-ylamine, AldrichCPR

Chemical Property of 3-methyl-1-propyl-1H-pyrazol-5-amine

Chemical Property:

• Vapor Pressure: 0.0119mmHg at 25°C
• Boiling Point: 260.9oC at 760 mmHg
• PKA: 4.66±0.10(Predicted)
• Flash Point: 111.6oC
• PSA: 43.84000
• Density: 1.09g/cm3
• LogP: 1.76490
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 139.110947427
• Heavy Atom Count: 10
• Complexity: 105

Purity/Quality:

97% ^*data from raw suppliers

3-Methyl-1-propyl-1H-pyrazol-5-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,T
• Statements: 25
• Safety Statements: 45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCN1C(=CC(=N1)C)N

Technology Process of 3-methyl-1-propyl-1H-pyrazol-5-amine

There total 4 articles about 3-methyl-1-propyl-1H-pyrazol-5-amine 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: 99.0%

→ 3-methyl-1-propyl-1H-pyrazol-5-amine (3524-34-3)

Guidance literature:

Reference yield:

Cyanoaceton (2469-99-0) + propyl hydrazine hydrochloride (56795-66-5,70629-59-3,73544-93-1) → 3-methyl-1-propyl-1H-pyrazol-5-amine (3524-34-3)

Guidance literature:

Reflux;

Reference yield:

3-Aminocrotononitrile (1118-61-2) + n-propylhydrazine (5039-61-2) → 3-methyl-1-propyl-1H-pyrazol-5-amine (3524-34-3)

Guidance literature:

With hydrogenchloride; Multistep reaction; 1.) EtOH, reflux, 18 h, 2.) EtOH, reflux, 18 h;

DOI:10.1021/jm00377a003

upstream raw materials:

3-Aminocrotononitrile

n-propylhydrazine

Cyanoaceton

propyl hydrazine hydrochloride

Downstream raw materials:

4-chloro-3-methyl-1-propyl-1H-pyrazolo[3,4-b]pyridine-5-carbonyl chloride

4-chloro-3-methyl-1-propyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid

5-amino-4-<(2-bromo-5-nitrophenyl)azo>-3-methyl-1-propylpyrazole