4-(5-Bromo-2-pyridylmethyloxy)nitrobenzene

HCID 20537913
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Basic information

Standard SMILES
O=[N+]([O-])c1ccc(OCc2ccc(Br)cn2)cc1
InChIKey
AAOQSQCERQYZLT-UHFFFAOYSA-N
Molecular formula
C12H9BrN2O3
Average molar mass
309.11 g/mol

Names & identifiers

Preferred name
4-(5-Bromo-2-pyridylmethyloxy)nitrobenzene
IUPAC
5-bromo-2-[(4-nitrophenoxy)methyl]pyridine

Names & synonyms

SCHEMBL11249557AAOQSQCERQYZLT-UHFFFAOYSA-N4-(5-bromo-2-pyridylmethyloxy)nitrobenzene

Database identifiers

PubChem CID
20537913

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
67.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
18

Related reactions

1 records
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Compound notes

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