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3-Ethylindol-2-one (HCID 21986279)|Huagongshe
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Compound
3-Ethylindol-2-one
HCID
21986279
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
CCC1=c2ccccc2=NC1=O
InChIKey
MXVLGQWQGUUHIV-UHFFFAOYSA-N
Molecular formula
C10H9NO
Average molar mass
159.18 g/mol
Names & identifiers
Preferred name
3-Ethylindol-2-one
IUPAC
3-ethylindol-2-one
Names & synonyms
3-ethylindol-2-one
3-Ethyl-indol-2-one
SCHEMBL3520478
SCHEMBL9159521
MXVLGQWQGUUHIV-UHFFFAOYSA-N
Database identifiers
PubChem CID
21986279
Properties
Computed structural properties
XLogP
1.7
Topological polar surface area
29.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
356
Show all 8
Show all 8 / 8
Related reactions
23 records
New reaction record
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
6985
As product
uspto-grants-2006_08
HRID
9326
As product
uspto-grants-2006_08
HRID
9327
As reactant
uspto-grants-2006_08
HRID
276998
As product
uspto-grants-2002_03
HRID
276999
As reactant
uspto-grants-2002_03
HRID
396227
As product
uspto-grants-2003_08
HRID
396229
As reactant
uspto-grants-2003_08
HRID
496680
As product
uspto-grants-2005_09
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