1-(3-(Benzyloxy)-6-bromopyridin-2-yl)ethanone

HCID 86662736
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Basic information

Standard SMILES
CC(=O)c1nc(Br)ccc1OCc1ccccc1
InChIKey
PMDBHUJQVUCARX-UHFFFAOYSA-N
Molecular formula
C14H12BrNO2
Average molar mass
306.15 g/mol

Names & identifiers

Preferred name
1-(3-(Benzyloxy)-6-bromopyridin-2-yl)ethanone
IUPAC
1-(6-bromo-3-phenylmethoxy-2-pyridinyl)ethanone

Names & synonyms

1-(3-(Benzyloxy)-6-bromopyridin-2-yl)ethanone1-[3-(benzyloxy)-6-bromopyridin-2-yl]ethanoneSCHEMBL716542PMDBHUJQVUCARX-UHFFFAOYSA-NDB-2008891186542-36-8

Database identifiers

PubChem CID
86662736

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
39.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
18

Related reactions

2 records
New reaction record

Compound notes

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