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Compound
N-[2-(3-chlorophenyl)-1-(4-chlorophenyl)but-3-enyl]acetamide
HCID
76834572
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
C=CC(c1cccc(Cl)c1)C(NC(C)=O)c1ccc(Cl)cc1
InChIKey
MEMBFIOCTNWUEG-UHFFFAOYSA-N
Molecular formula
C18H17Cl2NO
Average molar mass
334.2 g/mol
Names & identifiers
Preferred name
N-[2-(3-chlorophenyl)-1-(4-chlorophenyl)but-3-enyl]acetamide
IUPAC
N-[2-(3-chlorophenyl)-1-(4-chlorophenyl)but-3-enyl]acetamide
Names & synonyms
SCHEMBL23518101
Database identifiers
PubChem CID
76834572
Properties
Computed structural properties
XLogP
4.9
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
5
Heavy atoms
22
Formal charge
0
Complexity
379
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
106372
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
179011
As product
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Compound notes
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