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4-Nonanoyloxy-2,3,5,6-tetrafluorophenol (HCID 9836841)|Huagongshe
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Compound
4-Nonanoyloxy-2,3,5,6-tetrafluorophenol
HCID
9836841
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Basic information
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Properties
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Compound notes
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Basic information
Standard SMILES
CCCCCCCCC(=O)Oc1c(F)c(F)c(O)c(F)c1F
InChIKey
JASMXDWQDAVBDJ-UHFFFAOYSA-N
Molecular formula
C15H18F4O3
Average molar mass
322.29 g/mol
Names & identifiers
Preferred name
4-Nonanoyloxy-2,3,5,6-tetrafluorophenol
IUPAC
(2,3,5,6-tetrafluoro-4-hydroxyphenyl) nonanoate
Names & synonyms
SCHEMBL7770776
JASMXDWQDAVBDJ-UHFFFAOYSA-N
4-nonanoyloxy-2,3,5,6-tetrafluorophenol
Database identifiers
PubChem CID
9836841
Properties
Computed structural properties
XLogP
5.3
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
9
Heavy atoms
22
Formal charge
0
Complexity
327
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Related reactions
1 records
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As reactant
As product
As reagent
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As solvent
HRID
1587256
As product
uspto-grants-1993_06
Compound notes
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