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Compound
4-(Dodecyloxy)-1-naphthaldehyde
HCID
85841201
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
CCCCCCCCCCCCOc1ccc(C=O)c2ccccc12
InChIKey
RKULVGXXEHLDJG-UHFFFAOYSA-N
Molecular formula
C23H32O2
Average molar mass
340.5 g/mol
Monoisotopic mass
340.24023026
Names & identifiers
Preferred name
4-(Dodecyloxy)-1-naphthaldehyde
IUPAC
4-dodecoxynaphthalene-1-carbaldehyde
Names & synonyms
SCHEMBL1856050
4-(dodecyloxy)-1-naphthaldehyde
RKULVGXXEHLDJG-UHFFFAOYSA-N
Database identifiers
PubChem CID
85841201
Properties
Computed structural properties
XLogP
8.2
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
13
Heavy atoms
25
Formal charge
0
Complexity
341
Show all 8
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Related reactions
9 records
New reaction record
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
95349
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
208380
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID
294624
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
735919
As product
uspto-grants-2009_09
HRID
735920
As reactant
uspto-grants-2009_09
HRID
735993
As reactant
uspto-grants-2009_09
HRID
735997
As reactant
uspto-grants-2009_09
HRID
736001
As reactant
uspto-grants-2009_09
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