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Compound
2-(12-Heneicosenyl)-2-oxazoline
HCID
54550523
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Basic information
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Properties
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Basic information
Standard SMILES
CCCCCCCCC=CCCCCCCCCCCCC1=NCCO1
InChIKey
ZJOYJEWLHXERTJ-UHFFFAOYSA-N
Molecular formula
C24H45NO
Average molar mass
363.6 g/mol
Names & identifiers
Preferred name
2-(12-Heneicosenyl)-2-oxazoline
IUPAC
2-henicos-12-enyl-4,5-dihydro-1,3-oxazole
Names & synonyms
SCHEMBL9160076
ZJOYJEWLHXERTJ-UHFFFAOYSA-N
2-(12-heneicosenyl)-2-oxazoline
Database identifiers
PubChem CID
54550523
Properties
Computed structural properties
XLogP
9.4
Topological polar surface area
21.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
19
Heavy atoms
26
Formal charge
0
Complexity
348
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
654281
As product
uspto-grants-1992_07
HRID
693521
As product
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Compound notes
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