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Compound
Ethyl 2-propoxybenzenecarboximidate
HCID
4180854
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Basic information
Standard SMILES
CCCOc1ccccc1C(=N)OCC
InChIKey
JUTSDGNBZVSBAM-UHFFFAOYSA-N
Molecular formula
C12H17NO2
Average molar mass
207.27 g/mol
Monoisotopic mass
207.12592879
Names & identifiers
Preferred name
Ethyl 2-propoxybenzenecarboximidate
IUPAC
ethyl 2-propoxybenzenecarboximidate
Database identifiers
PubChem CID
4180854
Properties
Computed structural properties
XLogP
3.1
Topological polar surface area
42.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
15
Formal charge
0
Complexity
194
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Related reactions
1 records
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As solvent
HRID
309325
As product
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Compound notes
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