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Compound
N-ethoxy-2,4-dibromobutyric acid amide
HCID
86632273
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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
CCONC(=O)C(Br)CCBr
InChIKey
HLZZZJUGGHOMKQ-UHFFFAOYSA-N
Molecular formula
C6H11Br2NO2
Average molar mass
288.96 g/mol
Names & identifiers
Preferred name
N-ethoxy-2,4-dibromobutyric acid amide
IUPAC
2,4-dibromo-N-ethoxybutanamide
Names & synonyms
N-ethoxy-2,4-dibromobutyric acid amide
SCHEMBL2080643
HLZZZJUGGHOMKQ-UHFFFAOYSA-N
Database identifiers
PubChem CID
86632273
Properties
Computed structural properties
XLogP
1.9
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
11
Formal charge
0
Complexity
121
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
298489
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
601737
As reactant
uspto-grants-2011_03
Compound notes
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