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Compound
Formyloctadecanonitrile
HCID
20520510
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
CCCCCCCCCCCCCCCCC(C#N)C=O
InChIKey
MIJZWLDHJDTRFZ-UHFFFAOYSA-N
Molecular formula
C19H35NO
Average molar mass
293.5 g/mol
Monoisotopic mass
293.27186474
Names & identifiers
Preferred name
Formyloctadecanonitrile
IUPAC
2-formyloctadecanenitrile
Names & synonyms
formyloctadecanonitrile
SCHEMBL10975985
MIJZWLDHJDTRFZ-UHFFFAOYSA-N
Database identifiers
PubChem CID
20520510
Properties
Computed structural properties
XLogP
8.1
Topological polar surface area
40.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
16
Heavy atoms
21
Formal charge
0
Complexity
266
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Related reactions
1 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
223689
As product
uspto-grants-1982_10
Compound notes
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