4-Amino-2,3-difluorobenzoic acid

Base Information

• Chemical Name: 4-Amino-2,3-difluorobenzoic acid
• CAS No.: 194804-85-8
• Molecular Formula: C7H5F2NO2
• Molecular Weight: 173.119
• Hs Code.: 2922290090
• DSSTox Substance ID: DTXSID00376439
• Wikidata: Q72435846
• Mol file: 194804-85-8.mol

Synonyms:4-Amino-2,3-difluorobenzoic acid;194804-85-8;4-amino-2,3-difluoro-benzoic acid;Benzoic acid, 4-amino-2,3-difluoro-;4-amino-2,3-difluorobenzoicacid;SCHEMBL600522;AMY6470;DTXSID00376439;NGORASPPURCGPF-UHFFFAOYSA-N;MFCD04114097;AKOS005064026;AB17887;AC-3877;DS-1773;CS-0028802;FT-0651096;A19951;EN300-4265931;Z1255450748

Chemical Property of 4-Amino-2,3-difluorobenzoic acid

Chemical Property:

• Vapor Pressure: 0.000135mmHg at 25°C
• Refractive Index: 1.578
• Boiling Point: 320.1 °C at 760 mmHg
• PKA: 3.59±0.10(Predicted)
• Flash Point: 147.4 °C
• PSA: 63.32000
• Density: 1.536 g/cm³
• LogP: 1.82640
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 173.02883473
• Heavy Atom Count: 12
• Complexity: 188

Purity/Quality:

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

4-Amino-2,3-difluorobenzoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1C(=O)O)F)F)N