5-Bromo-2-chloro-4-methoxybenzoic acid

HCID 53329403
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Basic information

Standard SMILES
COc1cc(Cl)c(C(=O)O)cc1Br
InChIKey
BPCNHCKYILXFQR-UHFFFAOYSA-N
Molecular formula
C8H6BrClO3
Average molar mass
265.49 g/mol

Names & identifiers

Preferred name
5-Bromo-2-chloro-4-methoxybenzoic acid
IUPAC
5-bromo-2-chloro-4-methoxybenzoic acid

Names & synonyms

5-bromo-2-chloro-4-methoxybenzoic acid1259020-48-8SCHEMBL2129095BPCNHCKYILXFQR-UHFFFAOYSA-NMFCD243872665-bromo-4-methoxy-2-chlorobenzoic acidDB-427448H74143EN300-1689081

Database identifiers

PubChem CID
53329403

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
13

Related reactions

5 records
New reaction record

Compound notes

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