4-Fluoro-3-formylbenzoic acid

Base Information

• Chemical Name: 4-Fluoro-3-formylbenzoic acid
• CAS No.: 845885-90-7
• Molecular Formula: C8H5 F O3
• Molecular Weight: 168.124
• Hs Code.: 2916399090
• European Community (EC) Number: 827-813-0
• DSSTox Substance ID: DTXSID40383440
• Wikidata: Q72479822
• Mol file: 845885-90-7.mol

Synonyms:4-fluoro-3-formylbenzoic acid;845885-90-7;4-fluoro-3-formyl-benzoic Acid;3-FORMYL-4-FLUOROBENZOIC ACID;4-Fluoro-3-formylbenzoicacid;SCHEMBL1955496;DTXSID40383440;SKPWEADPCJMLID-UHFFFAOYSA-N;CL8087;MFCD06411555;AKOS006229732;AC-9349;AM84188;CS-W005270;DS-11650;4'-Methoxy-2,2',4-trimethyl-diphenylamine;4-fluoro-3-formyl-benzoic acid, AldrichCPR;FT-0646595;EN300-300887;Z1198168885

Chemical Property of 4-Fluoro-3-formylbenzoic acid

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 152 °C
• Refractive Index: 1.593
• Boiling Point: 332.301°C at 760 mmHg
• PKA: 3.79±0.10(Predicted)
• Flash Point: 154.771°C
• PSA: 54.37000
• Density: 1.427g/cm³
• LogP: 1.33640
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 168.02227218
• Heavy Atom Count: 12
• Complexity: 193

Purity/Quality:

98%min ^*data from raw suppliers

4-Fluoro-3-formylbenzoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

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