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2-(Pyrid-3-yl)cyclohexanone (HCID 10976010)|Huagongshe
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Compound
2-(Pyrid-3-yl)cyclohexanone
HCID
10976010
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
O=C1CCCCC1c1cccnc1
InChIKey
TZWLYMJGRGFVPX-UHFFFAOYSA-N
Molecular formula
C11H13NO
Average molar mass
175.23 g/mol
Names & identifiers
Preferred name
2-(Pyrid-3-yl)cyclohexanone
IUPAC
2-pyridin-3-ylcyclohexan-1-one
Names & synonyms
2-(pyrid-3-yl)cyclohexanone
SCHEMBL3438226
TZWLYMJGRGFVPX-UHFFFAOYSA-N
AKOS011898127
Database identifiers
PubChem CID
10976010
Properties
Computed structural properties
XLogP
1.6
Topological polar surface area
30 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
191
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Related reactions
3 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
5911
As reactant
uspto-grants-1993_09
HRID
817455
As reactant
Test data from https://doi.org/10.1039/C8SC04228D
HRID
1197484
As reactant
uspto-grants-1994_01
Compound notes
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