4-Carbamoyl-2-fluorobenzoic acid

Base Information

• Chemical Name: 4-Carbamoyl-2-fluorobenzoic acid
• CAS No.: 799265-47-7
• Molecular Formula: C8H6FNO3
• Molecular Weight: 183.14
• DSSTox Substance ID: DTXSID40360190
• Wikidata: Q82141806
• Mol file: 799265-47-7.mol

Synonyms:4-carbamoyl-2-fluorobenzoic acid;799265-47-7;2-Fluoroterephthalamic acid;4-(aminocarbonyl)-2-fluorobenzoic acid;SCHEMBL392941;4-carbamoyl-2-fluorobenzoicacid;DTXSID40360190;BBL034385;STL412351;AKOS000416347;2-fluoro-terephthalamic acid, AldrichCPR;VS-12506;BB 0259920;FT-0677292;EN300-379301

Chemical Property of 4-Carbamoyl-2-fluorobenzoic acid

Chemical Property:

• PSA: 80.39000
• LogP: 1.32310
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 183.03317122
• Heavy Atom Count: 13
• Complexity: 231

Purity/Quality:

98%min ^*data from raw suppliers

2-FluoroterephthalamicAcid ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

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