1-methyl-1H-pyrazole-3-carbonyl chloride

Base Information

• Chemical Name: 1-methyl-1H-pyrazole-3-carbonyl chloride
• CAS No.: 84547-60-4
• Molecular Formula: C5H5ClN2O
• Molecular Weight: 144.56
• Hs Code.: 2933199090
• European Community (EC) Number: 676-283-5
• DSSTox Substance ID: DTXSID40511322
• Wikidata: Q82370069
• Mol file: 84547-60-4.mol

Synonyms:1-methyl-1H-pyrazole-3-carbonyl chloride;84547-60-4;1-methylpyrazole-3-carbonyl chloride;MFCD03419367;1H-Pyrazole-3-carbonyl chloride, 1-methyl-;SCHEMBL166439;DTXSID40511322;JCZIPPIUHKRMOM-UHFFFAOYSA-N;AKOS000307982;AB92308;SY064601;VS-14125;BB 0260072;FT-0679537;EN300-228250;F2146-0663

Chemical Property of 1-methyl-1H-pyrazole-3-carbonyl chloride

Chemical Property:

• Vapor Pressure: 0.081mmHg at 25°C
• Refractive Index: 1.584
• Boiling Point: 226.568 °C at 760 mmHg
• Flash Point: 90.826 °C
• PSA: 34.89000
• Density: 1.37 g/cm³
• LogP: 0.79910
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 144.0090405
• Heavy Atom Count: 9
• Complexity: 128

Purity/Quality:

98%min ^*data from raw suppliers

1-methyl-1H-pyrazole-3-carbonylchloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C=CC(=N1)C(=O)Cl