{4-[4-(5-Bromo-pyridin-2-yl)-but-3-ynyl]-phenyl}-methanol

HCID 69070552
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Basic information

Standard SMILES
OCc1ccc(CCC#Cc2ccc(Br)cn2)cc1
InChIKey
DQLBEBIUFPDQHC-UHFFFAOYSA-N
Molecular formula
C16H14BrNO
Average molar mass
316.19 g/mol

Names & identifiers

Preferred name
{4-[4-(5-Bromo-pyridin-2-yl)-but-3-ynyl]-phenyl}-methanol
IUPAC
[4-[4-(5-bromo-2-pyridinyl)but-3-ynyl]phenyl]methanol

Names & synonyms

SCHEMBL4504786DQLBEBIUFPDQHC-UHFFFAOYSA-N{4-[4-(5-bromo-pyridin-2-yl)-but-3-ynyl]-phenyl}-methanol

Database identifiers

PubChem CID
69070552

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
33.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
19

Related reactions

7 records
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Compound notes

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