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Compound
1-Ethyl-5-formyloxindole
HCID
13770522
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
CCN1C(=O)Cc2cc(C=O)ccc21
InChIKey
DDGPTMMETJCKBM-UHFFFAOYSA-N
Molecular formula
C11H11NO2
Average molar mass
189.21 g/mol
Names & identifiers
Preferred name
1-Ethyl-5-formyloxindole
IUPAC
1-ethyl-2-oxo-3H-indole-5-carbaldehyde
Names & synonyms
1-ethyl-5-formyloxindole
SCHEMBL9665435
DDGPTMMETJCKBM-UHFFFAOYSA-N
Database identifiers
PubChem CID
13770522
Properties
Computed structural properties
XLogP
0.8
Topological polar surface area
37.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
252
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Related reactions
3 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
169324
As product
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
236357
As product
uspto-grants-1987_02
HRID
1788946
As product
uspto-grants-1987_08
Compound notes
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