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2-(Benzofuran-2-yl)-5-bromopyridine

HCID 22508335
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Brc1ccc(-c2cc3ccccc3o2)nc1
InChIKey
RQFHHDFBRVRBME-UHFFFAOYSA-N
Molecular formula
C13H8BrNO
Average molar mass
274.11 g/mol

Names & identifiers

Preferred name
2-(Benzofuran-2-yl)-5-bromopyridine
IUPAC
2-(1-benzofuran-2-yl)-5-bromopyridine

Names & synonyms

SCHEMBL4660617RQFHHDFBRVRBME-UHFFFAOYSA-N2-(2-Benzofuranyl)-5-bromopyridine2-(benzofuran-2-yl)-5-bromopyridineDB-181140462612-67-5

Database identifiers

PubChem CID
22508335

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
26 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
16
Formal charge
0
Complexity
248

Related reactions

3 records
New reaction record
HRID 93109 reaction equation
HRID 93109As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 984755 reaction equation
HRID 984755As reactantuspto-grants-2005_03
HRID 984756 reaction equation
HRID 984756As reactantuspto-grants-2005_03

Compound notes

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