4-Chloro-5,6-difluoronicotinic acid

Base Information

• Chemical Name: 4-Chloro-5,6-difluoronicotinic acid
• CAS No.: 851386-32-8
• Molecular Formula: C6H2ClF2NO2
• Molecular Weight: 193.54
• Hs Code.: 2933399090
• European Community (EC) Number: 813-475-1
• DSSTox Substance ID: DTXSID60459772
• Wikidata: Q72518414
• Mol file: 851386-32-8.mol

Synonyms:851386-32-8;4-Chloro-5,6-difluoronicotinic acid;4-chloro-5,6-difluoropyridine-3-carboxylic acid;MFCD09031172;4-chloro-5,6-difluoro-3-pyridinecarboxylic acid;4-chloro-5,6-difluoro-pyridine-3-carboxylic Acid;3-Pyridinecarboxylic acid, 4-chloro-5,6-difluoro-;SCHEMBL17134569;DTXSID60459772;SQMYITSFQKNMHA-UHFFFAOYSA-N;4-chloro-5,6-difluoronicotinicacid;BCP25801;AKOS006290076;CS-W023219;DS-0548;PB12582;AC-28799;SY111474;AM20061543;4-Chloro-5 pound not6-difluoronicotinic acid;A841232;4-chloranyl-5,6-bis(fluoranyl)pyridine-3-carboxylic acid;3-Pyridinecarboxylic acid, 4-chloro-5,6-difluoro- 4-Chloro-5,6-difluoropyridine-3-carboxylic acid 4-chloro-5,6-difluoronicotinicacid

Chemical Property of 4-Chloro-5,6-difluoronicotinic acid

Chemical Property:

• Vapor Pressure: 0.000621mmHg at 25°C
• Melting Point: 117-118 °C
• Refractive Index: 1.538
• Boiling Point: 297.1 °C at 760 mmHg
• PKA: 1.68±0.32(Predicted)
• Flash Point: 133.5 °C
• PSA: 50.19000
• Density: 1.674 g/cm³
• LogP: 1.71140
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 192.9742123
• Heavy Atom Count: 12
• Complexity: 192

Purity/Quality:

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

4-Chloro-5,6-difluoropyridine-3-carboxylic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C(=C(C(=N1)F)F)Cl)C(=O)O