3-Bromo-5-chloro-2,6-dimethoxybenzoic acid

HCID 2800463
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Basic information

CAS
73219-92-8
Standard SMILES
COc1c(Cl)cc(Br)c(OC)c1C(=O)O
InChIKey
VOIBMJIPLSKRQL-UHFFFAOYSA-N
Molecular formula
C9H8BrClO4
Average molar mass
295.51 g/mol

Names & identifiers

Preferred name
3-Bromo-5-chloro-2,6-dimethoxybenzoic acid
IUPAC
3-bromo-5-chloro-2,6-dimethoxybenzoic acid

Names & synonyms

3-bromo-5-chloro-2,6-dimethoxybenzoic acid73219-92-8MFCD00052935C9H8BrClO43-bromo-5-chloro-2,6-dimethoxy-benzoic AcidOprea1_646618SCHEMBL4831712VOIBMJIPLSKRQL-UHFFFAOYSA-NAKOS024370986AS-85060ST51007133

Database identifiers

CAS
73219-92-8
PubChem CID
2800463

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
55.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
15

Related reactions

6 records
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Compound notes

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