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3-(4-Fluorophenyl)pyrrolidin-2-one (HCID 67357724)|Huagongshe
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Compound
3-(4-Fluorophenyl)pyrrolidin-2-one
HCID
67357724
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Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
O=C1NCCC1c1ccc(F)cc1
InChIKey
QHHFKELBWSDWSV-UHFFFAOYSA-N
Molecular formula
C10H10FNO
Average molar mass
179.19 g/mol
Names & identifiers
Preferred name
3-(4-Fluorophenyl)pyrrolidin-2-one
IUPAC
3-(4-fluorophenyl)pyrrolidin-2-one
Names & synonyms
3-(4-fluorophenyl)pyrrolidin-2-one
1219626-26-2
SCHEMBL2307392
QHHFKELBWSDWSV-UHFFFAOYSA-N
Database identifiers
PubChem CID
67357724
Properties
Computed structural properties
XLogP
1.4
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
199
Show all 8
Show all 8 / 8
Related reactions
5 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
211886
As product
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID
819021
As reactant
Test data from https://doi.org/10.1039/C8SC04228D
HRID
1667228
As product
uspto-grants-2011_10
HRID
1667229
As reactant
uspto-grants-2011_10
HRID
1667252
As reactant
uspto-grants-2011_10
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Compound notes
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