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Compound
2-(Pyridin-4-yl)-methylene-indan-1-one
HCID
19973473
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Basic information
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Properties
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Compound notes
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Basic information
Standard SMILES
C=C1c2ccccc2C(=O)C1c1ccncc1
InChIKey
WEPCSJRIUJPNEW-UHFFFAOYSA-N
Molecular formula
C15H11NO
Average molar mass
221.25 g/mol
Monoisotopic mass
221.08406397
Names & identifiers
Preferred name
2-(Pyridin-4-yl)-methylene-indan-1-one
IUPAC
3-methylidene-2-pyridin-4-ylinden-1-one
Names & synonyms
SCHEMBL6274633
WEPCSJRIUJPNEW-UHFFFAOYSA-N
2-(Pyridin-4-yl)-methylene-indan-1-one
Database identifiers
PubChem CID
19973473
Properties
Computed structural properties
XLogP
2.4
Topological polar surface area
30 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
17
Formal charge
0
Complexity
330
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Related reactions
3 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
951364
As product
Validation data from https://doi.org/10.1039/C8SC04228D
HRID
1452032
As product
uspto-grants-1997_02
HRID
1452034
As reactant
uspto-grants-1997_02
Compound notes
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