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Compound
18-Iodononadeca-6,9,12-triene
HCID
54282916
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Basic information
Standard SMILES
CCCCCC=CCC=CCC=CCCCCC(C)I
InChIKey
RSAQQWSLGRHBNZ-UHFFFAOYSA-N
Molecular formula
C19H33I
Average molar mass
388.4 g/mol
Names & identifiers
Preferred name
18-Iodononadeca-6,9,12-triene
IUPAC
18-iodononadeca-6,9,12-triene
Names & synonyms
SCHEMBL11869451
Database identifiers
PubChem CID
54282916
Properties
Computed structural properties
XLogP
8.7
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
13
Heavy atoms
20
Formal charge
0
Complexity
263
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Related reactions
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As reactant
As product
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As solvent
HRID
957215
As product
Validation data from https://doi.org/10.1039/C8SC04228D
Compound notes
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