5-(2-chloro-6-fluorophenyl)-2H-tetrazole

Base Information

• Chemical Name: 5-(2-chloro-6-fluorophenyl)-2H-tetrazole
• CAS No.: 503293-47-8
• Molecular Formula: C7H4 Cl F N4
• Molecular Weight: 174.5634632
• Hs Code.: 2933998090
• European Community (EC) Number: 664-234-0
• DSSTox Substance ID: DTXSID30368286
• Wikidata: Q72451301
• Mol file: 503293-47-8.mol

Synonyms:503293-47-8;5-(2-chloro-6-fluorophenyl)-2H-tetrazole;6-Chloro-2-fluorobenzotetrazole;5-(2-CHLORO-6-FLUORO-PHENYL)-2H-TETRAZOLE;Enamine_005342;HMS1409C18;SCHEMBL3305051;SCHEMBL13390499;DTXSID30368286;MFCD16304624;AKOS000116492;AKOS008966879;5-(2-Chloro-6-fluorophenyl)-1H-tetraZole;FT-0692609;A828068;Z56913124

Chemical Property of 5-(2-chloro-6-fluorophenyl)-2H-tetrazole

Chemical Property:

• Vapor Pressure: 2.28E-05mmHg at 25°C
• Boiling Point: 360.1°C at 760 mmHg
• PKA: 3.20±0.10(Predicted)
• Flash Point: 171.6°C
• PSA: 54.46000
• Density: 1.54g/cm³
• LogP: 1.65920
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 198.0108520
• Heavy Atom Count: 13
• Complexity: 182

Purity/Quality:

98%Min ^*data from raw suppliers

5-(2-CHLORO-6-FLUOROPHENYL)-2H-TETRAZOLE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1)Cl)C2=NNN=N2)F