1-(2-bromoethyl)-3-methyl-1H-pyrazole

Base Information

• Chemical Name: 1-(2-bromoethyl)-3-methyl-1H-pyrazole
• CAS No.: 724704-85-2
• Molecular Formula: C6H9BrN2
• Molecular Weight: 189.05
• Hs Code.: 2933199090
• DSSTox Substance ID: DTXSID60587968
• Wikidata: Q82480446
• Mol file: 724704-85-2.mol

Synonyms:1-(2-bromoethyl)-3-methyl-1H-pyrazole;724704-85-2;1-(2-bromoethyl)-3-methylpyrazole;SCHEMBL1780286;DTXSID60587968;MFCD02855992;AKOS006278852;MCULE-2599842965;BS-36366;DB-362709;CS-0317270

Chemical Property of 1-(2-bromoethyl)-3-methyl-1H-pyrazole

Chemical Property:

• Vapor Pressure: 0.099mmHg at 25°C
• Boiling Point: 230.6°C at 760 mmHg
• PKA: 2.32±0.10(Predicted)
• Flash Point: 93.2°C
• PSA: 17.82000
• Density: 1.48g/cm³
• LogP: 1.58640
• Storage Temp.: 2-8°C
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 187.99491
• Heavy Atom Count: 9
• Complexity: 87.1

Purity/Quality:

99% ^*data from raw suppliers

1-(2-bromoethyl)-3-methyl-1H-pyrazole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NN(C=C1)CCBr