4,5-Dichloro-2-fluorobenzoic acid

Base Information

• Chemical Name: 4,5-Dichloro-2-fluorobenzoic acid
• CAS No.: 289039-49-2
• Molecular Formula: C7H3Cl2FO2
• Molecular Weight: 209.004
• Hs Code.: 2916399090
• European Community (EC) Number: 630-255-9
• DSSTox Substance ID: DTXSID30378840
• Wikidata: Q72466231
• Mol file: 289039-49-2.mol

Synonyms:4,5-dichloro-2-fluorobenzoic acid;289039-49-2;4,5-dichloro-2-fluoro-benzoic Acid;4,5-Dichloro-2-fluorobenzoicacid;MFCD00672988;Benzoicacid, 4,5-dichloro-2-fluoro-;SCHEMBL14331830;DTXSID30378840;XFOJZPTYJMXNKK-UHFFFAOYSA-N;CK1083;AKOS015850096;CS-W022046;PS-8030;Benzoic acid, 4,5-dichloro-2-fluoro-;AC-26036;SY030903;AM20060007;FT-0649391;A20282;J-514081

Chemical Property of 4,5-Dichloro-2-fluorobenzoic acid

Chemical Property:

• Vapor Pressure: 0.000379mmHg at 25°C
• Refractive Index: 1.574
• Boiling Point: 304.6 °C at 760 mmHg
• PKA: 2.67±0.10(Predicted)
• Flash Point: 138 °C
• PSA: 37.30000
• Density: 1.606 g/cm³
• LogP: 2.83070
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 207.9494129
• Heavy Atom Count: 12
• Complexity: 188

Purity/Quality:

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

4,5-Dichloro-2-fluorobenzoicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C(=CC(=C1Cl)Cl)F)C(=O)O