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N-(2-(2,4-dichlorophenoxy)ethyl)propylamide

HCID 86736788
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCC[N-]CCOc1ccc(Cl)cc1Cl
InChIKey
IJGXPPWAWZDSJJ-UHFFFAOYSA-N
Molecular formula
C11H14Cl2NO-
Average molar mass
247.14 g/mol

Names & identifiers

Preferred name
N-(2-(2,4-dichlorophenoxy)ethyl)propylamide
IUPAC
2-(2,4-dichlorophenoxy)ethyl-propylazanide

Names & synonyms

IJGXPPWAWZDSJJ-UHFFFAOYSA-NN-(2-(2,4-dichlorophenoxy)ethyl)propylamide

Database identifiers

PubChem CID
86736788

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
10.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
15
Formal charge
-1
Complexity
169

Related reactions

2 records
New reaction record
HRID 115003 reaction equation
HRID 115003As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 2052367 reaction equation
HRID 2052367As reactantuspto-grants-1980_01

Compound notes

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