2-(2,4-Dichlorobenzoyl)benzoic acid

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Basic information

CAS: 61959-32-8
Standard SMILES: O=C(O)c1ccccc1C(=O)c1ccc(Cl)cc1Cl
InChIKey: SSRBKRHBIFAERH-UHFFFAOYSA-N
Molecular formula: C14H8Cl2O3
Average molar mass: 295.1 g/mol
Monoisotopic mass: 293.9850495

Names & identifiers

Preferred name: 2-(2,4-Dichlorobenzoyl)benzoic acid
IUPAC: 2-(2,4-dichlorobenzoyl)benzoic acid

Names & synonyms

2-(2,4-dichlorobenzoyl)benzoic acid61959-32-8NSC511502Chlorthalidone RC 3Benzoic acid, 2-(2,4-dichlorobenzoyl)-SCHEMBL8864622DTXSID20325565SSRBKRHBIFAERH-UHFFFAOYSA-N2-(2,4-dichlorobenzoyl)benzoicacidMFCD01013746AKOS009144399NSC-511502

Database identifiers

CAS: 61959-32-8
PubChem CID: 350482
DTXSID: DTXSID20325565

Properties

Computed structural properties

XLogP: 4
Topological polar surface area: 54.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 19
Formal charge: 0
Complexity: 359

Related reactions

1 records

New reaction record

HRID 615663As productuspto-grants-1985_02

Compound notes

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