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5-[(4-Fluorophenoxy)methyl]tetrahydro-3-furanthiol

HCID 18924004
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Fc1ccc(OCC2CC(S)CO2)cc1
InChIKey
LKSWUIDOWSLHBX-UHFFFAOYSA-N
Molecular formula
C11H13FO2S
Average molar mass
228.28 g/mol

Names & identifiers

Preferred name
5-[(4-Fluorophenoxy)methyl]tetrahydro-3-furanthiol
IUPAC
5-[(4-fluorophenoxy)methyl]oxolane-3-thiol

Names & synonyms

SCHEMBL8644535LKSWUIDOWSLHBX-UHFFFAOYSA-N5-[(4-Fluorophenoxy)methyl]tetrahydro-3-furanthiol

Database identifiers

PubChem CID
18924004

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
19.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
15
Formal charge
0
Complexity
195

Related reactions

6 records
New reaction record
HRID 54773 reaction equation
HRID 54773As productuspto-grants-1997_04
HRID 192448 reaction equation
HRID 192448As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1290362 reaction equation
HRID 1290362As productuspto-grants-1998_05
HRID 1450288 reaction equation
HRID 1450288As productuspto-grants-1997_02
HRID 1600097 reaction equation
HRID 1600097As productuspto-grants-1998_04
HRID 2142134 reaction equation
HRID 2142134As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes