5-Chloro-3-methyl-4-nitro-1H-pyrazole

Base Information

• Chemical Name: 5-Chloro-3-methyl-4-nitro-1H-pyrazole
• CAS No.: 6814-58-0
• Deprecated CAS: 13551-81-0,66163-48-2,73536-00-2,83588-42-5,52452-89-8,383383-22-0,52452-89-8,524726-08-7,66163-48-2,73536-00-2,83588-42-5,925643-70-5,948551-16-4
• Molecular Formula: C4H4ClN3O2
• Molecular Weight: 161.54646
• Hs Code.: 2933199090
• European Community (EC) Number: 639-814-1
• UNII: N8UW78C99U
• DSSTox Substance ID: DTXSID3058454
• Nikkaji Number: J8.843I
• Wikidata: Q27284715
• Mol file: 6814-58-0.mol

Synonyms:5-chloro-3-methyl-4-nitro-1H-pyrazole;CMN pyrazole

Chemical Property of 5-Chloro-3-methyl-4-nitro-1H-pyrazole

Chemical Property:

• Vapor Pressure: 3.13E-05mmHg at 25°C
• Melting Point: 111°C
• Refractive Index: 1.61
• Boiling Point: 366.2 ºC at 760 mmHg
• PKA: 7.23±0.50(Predicted)
• Flash Point: 175.3ºC
• PSA: 74.50000
• Density: 1.598 g/cm³
• LogP: 1.80290
• Storage Temp.: -20°C Freezer
• Solubility.: Chloroform, DMSO (Slightly), Methanol (Slightly)
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 160.9992041
• Heavy Atom Count: 10
• Complexity: 148

Purity/Quality:

98%,99%, ^*data from raw suppliers

5-Chloro-3-methyl-4-nitro-1H-pyrazole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C(=NN1)Cl)[N+](=O)[O-]
• Recent ClinicalTrials: The Effects of the GOLO for Life? Plan and Release Supplement on Weight Management in Overweight and Obese Adults
• Uses: 5-Chloro-3-methyl-4-nitro-1H-pyrazole (CMNP) is a pyrazole-derived plant growth regulator used as a citrus abscission agent.