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Compound
N-(4-phenoxybutyl)acrylic amide
HCID
13650883
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Basic information
Names & identifiers
Properties
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Basic information
Standard SMILES
C=CC(=O)NCCCCOc1ccccc1
InChIKey
HVEBGWVTTRPRCD-UHFFFAOYSA-N
Molecular formula
C13H17NO2
Average molar mass
219.28 g/mol
Monoisotopic mass
219.12592879
Names & identifiers
Preferred name
N-(4-phenoxybutyl)acrylic amide
IUPAC
N-(4-phenoxybutyl)prop-2-enamide
Names & synonyms
SCHEMBL10363148
N-(4-phenoxybutyl)acrylic amide
HVEBGWVTTRPRCD-UHFFFAOYSA-N
Database identifiers
PubChem CID
13650883
Properties
Computed structural properties
XLogP
2.5
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
7
Heavy atoms
16
Formal charge
0
Complexity
210
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
140515
As product
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
1906069
As product
uspto-grants-1987_03
Compound notes
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