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1-Lauroyloxymethyl-5-fluorouracil (HCID 13014281)|Huagongshe
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Compound
1-Lauroyloxymethyl-5-fluorouracil
HCID
13014281
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
CCCCCCCCCCCC(=O)OCn1cc(F)c(=O)[nH]c1=O
InChIKey
USKFDHVYOWSIBC-UHFFFAOYSA-N
Molecular formula
C17H27FN2O4
Average molar mass
342.4 g/mol
Names & identifiers
Preferred name
1-Lauroyloxymethyl-5-fluorouracil
IUPAC
(5-fluoro-2,4-dioxopyrimidin-1-yl)methyl dodecanoate
Names & synonyms
SCHEMBL11393256
1-lauroyloxymethyl-5-fluorouracil
USKFDHVYOWSIBC-UHFFFAOYSA-N
Database identifiers
PubChem CID
13014281
Properties
Computed structural properties
XLogP
4.8
Topological polar surface area
75.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
13
Heavy atoms
24
Formal charge
0
Complexity
466
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
1147630
As product
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID
2286696
As product
uspto-grants-1981_05
Compound notes
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