5-((2,2,2-Trifluoroacetamido)methyl)-2-chloro-4-fluorobenzoic acid

HCID 89736668
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Basic information

Standard SMILES
O=C(O)c1cc(CNC(=O)C(F)(F)F)c(F)cc1Cl
InChIKey
IUIIZLHPRIMFPX-UHFFFAOYSA-N
Molecular formula
C10H6ClF4NO3
Average molar mass
299.6 g/mol

Names & identifiers

Preferred name
5-((2,2,2-Trifluoroacetamido)methyl)-2-chloro-4-fluorobenzoic acid
IUPAC
2-chloro-4-fluoro-5-[[(2,2,2-trifluoroacetyl)amino]methyl]benzoic acid

Names & synonyms

5-((2,2,2-trifluoroacetamido)methyl)-2-chloro-4-fluorobenzoic acidSCHEMBL15170264

Database identifiers

PubChem CID
89736668

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
66.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
19

Related reactions

4 records
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Compound notes

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