5-Chloro-2-phenyl-3,4-dihydropyrazole

Base Information

• Chemical Name: 5-Chloro-2-phenyl-3,4-dihydropyrazole
• CAS No.: 58469-32-2
• Molecular Formula: C9H9ClN2
• Molecular Weight: 180.637
• DSSTox Substance ID: DTXSID40354958
• Nikkaji Number: J2.157.759F
• Wikidata: Q82133486
• Mol file: 58469-32-2.mol

Synonyms:5-chloro-2-phenyl-3,4-dihydropyrazole;3-chloro-1-phenyl-4,5-dihydro-1H-pyrazole;58469-32-2;STK037974;SCHEMBL2730663;3-chloro-1-phenyl-2-pyrazoline;DTXSID40354958;ZKNNWNWLWVAMCK-UHFFFAOYSA-N;HMS1577J15;CCG-2318;AKOS005382298;3-Chloro-4,5-dihydro-1-phenylpyrazole;3-Chloro-4,5-dihydro-1-phenyl-1H-pyrazole;AG-690/11141128

Chemical Property of 5-Chloro-2-phenyl-3,4-dihydropyrazole

Chemical Property:

• Boiling Point: 267.2±23.0 °C(Predicted)
• PSA: 15.60000
• Density: 1.24±0.1 g/cm3(Predicted)
• LogP: 1.94960
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 180.0454260
• Heavy Atom Count: 12
• Complexity: 185

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(N=C1Cl)C2=CC=CC=C2