3-Chloro-4,5-difluorobenzoic acid

Base Information

• Chemical Name: 3-Chloro-4,5-difluorobenzoic acid
• CAS No.: 150444-95-4
• Molecular Formula: C7H3ClF2O2
• Molecular Weight: 192.549
• Hs Code.: 2916399090
• European Community (EC) Number: 695-884-3
• DSSTox Substance ID: DTXSID20565924
• Wikidata: Q82451268
• Mol file: 150444-95-4.mol

Synonyms:3-Chloro-4,5-difluorobenzoic acid;150444-95-4;Benzoic acid, 3-chloro-4,5-difluoro-;3-Chloro-4,5-difluoro-benzoic acid;MFCD04972707;3-chloro -4,5-difluorobenzoic acid;SCHEMBL2431319;DTXSID20565924;RRJYBDSJDKWHOS-UHFFFAOYSA-N;CL8080;AKOS005063904;DS-12273;SY258292;CS-0157721;2-PYRIDINEALDOXIMEMETHYLMETHANESULFONATE;A19971;EN300-192703

Chemical Property of 3-Chloro-4,5-difluorobenzoic acid

Chemical Property:

• Vapor Pressure: 0.0015mmHg at 25°C
• Refractive Index: 1.534
• Boiling Point: 283.276 °C at 760 mmHg
• PKA: 3.43±0.10(Predicted)
• Flash Point: 125.121 °C
• PSA: 37.30000
• Density: 1.574 g/cm³
• LogP: 2.31640
• Storage Temp.: 2-8°C
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 191.9789634
• Heavy Atom Count: 12
• Complexity: 188

Purity/Quality:

98%min ^*data from raw suppliers

3-Chloro-4,5-difluorobenzoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1F)F)Cl)C(=O)O