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Compound
5,6,3'-Trimethyl-[2,2']bipyridin-3-ol
HCID
136385111
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
Cc1cc(O)c(-c2ncccc2C)nc1C
InChIKey
NBUGALYJPSBRNT-UHFFFAOYSA-N
Molecular formula
C13H14N2O
Average molar mass
214.26 g/mol
Names & identifiers
Preferred name
5,6,3'-Trimethyl-[2,2']bipyridin-3-ol
IUPAC
5,6-dimethyl-2-(3-methyl-2-pyridinyl)pyridin-3-ol
Names & synonyms
SCHEMBL3898349
NBUGALYJPSBRNT-UHFFFAOYSA-N
5,6,3'-trimethyl-[2,2']bipyridin-3-ol
Database identifiers
PubChem CID
136385111
Properties
Computed structural properties
XLogP
2.3
Topological polar surface area
46 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Formal charge
0
Complexity
234
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Related reactions
3 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
229050
As product
uspto-grants-2009_07
HRID
229051
As reactant
uspto-grants-2009_07
HRID
687736
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Compound notes
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