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1-Ethyl-2-iodoquinolin-1-ium (HCID 78527)|Huagongshe
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Compound
1-Ethyl-2-iodoquinolin-1-ium
HCID
78527
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Basic information
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Properties
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Basic information
Standard SMILES
CC[n+]1c(I)ccc2ccccc21
InChIKey
XIFBEHMCTYOYFM-UHFFFAOYSA-N
Molecular formula
C11H11IN+
Average molar mass
284.12 g/mol
Names & identifiers
Preferred name
1-Ethyl-2-iodoquinolin-1-ium
IUPAC
1-ethyl-2-iodoquinolin-1-ium
Database identifiers
PubChem CID
78527
Nikkaji
J415.400B
Properties
Computed structural properties
XLogP
3.3
Topological polar surface area
3.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
1
Heavy atoms
13
Formal charge
1
Complexity
171
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Related reactions
1 records
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As solvent
HRID
201484
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Compound notes
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