2,3,4,5-Tetrachloro-6-[(2-fluorophenyl)carbamoyl]benzoic acid
Basic information
- CAS
61747-73-7- Standard SMILES
O=C(O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1C(=O)Nc1ccccc1F- InChIKey
NMKSTKIEBAIEPL-UHFFFAOYSA-N- Molecular formula
- C14H6Cl4FNO3
- Average molar mass
- 397 g/mol
- Monoisotopic mass
- 394.908582
Overview
See also: 2'-Fluoro-3,4,5,6-tetrachlorophthalanilic acid (annotation moved to).
Names & identifiers
- Preferred name
- 2,3,4,5-Tetrachloro-6-[(2-fluorophenyl)carbamoyl]benzoic acid
- IUPAC
- 2,3,4,5-tetrachloro-6-[(2-fluorophenyl)carbamoyl]benzoic acid
Names & synonyms
61747-73-72,3,4,5-tetrachloro-6-[(2-fluorophenyl)carbamoyl]benzoic acid2,3,4,5-Tetrachloro-6-((2-fluorophenyl)carbamoyl)benzoic acidBenzoicacid, 2,3,4,5-tetrachloro-6-[[(2-fluorophenyl)amino]carbonyl]-NSC204689SCHEMBL7823201DTXSID60308514AKOS024432000NSC-2046892,3,4,5-tetrachloro-6-[(2-fluoroanilino)carbonyl]benzoic acid
Database identifiers
- CAS
61747-73-7- PubChem CID
- 306989
- DTXSID
DTXSID60308514
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 469
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Related reactions
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Compound notes
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