4-(3-(3,5-Dichlorophenyl)-4,4,4-trifluoro-2-butenoyl)benzoic acid

HCID 66735658
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Basic information

Standard SMILES
O=C(O)c1ccc(C(=O)C=C(c2cc(Cl)cc(Cl)c2)C(F)(F)F)cc1
InChIKey
KQUZUFXBYIPVIC-UHFFFAOYSA-N
Molecular formula
C17H9Cl2F3O3
Average molar mass
389.1 g/mol

Names & identifiers

Preferred name
4-(3-(3,5-Dichlorophenyl)-4,4,4-trifluoro-2-butenoyl)benzoic acid
IUPAC
4-[3-(3,5-dichlorophenyl)-4,4,4-trifluorobut-2-enoyl]benzoic acid

Names & synonyms

4-(3-(3,5-Dichlorophenyl)-4,4,4-trifluoro-2-butenoyl)benzoic acidSCHEMBL588712

Database identifiers

PubChem CID
66735658

Properties

Computed structural properties

XLogP
5.6
Topological polar surface area
54.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
25

Related reactions

6 records
New reaction record

Linked notes

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