3-[(3-fluorophenoxy)methyl]thiophene

C11H9FOS — CID 64763635

IUPAC3-[(3-fluorophenoxy)methyl]thiophene
SMILESFc1cccc(OCc2ccsc2)c1
InChIInChI=1S/C11H9FOS/c12-10-2-1-3-11(6-10)13-7-9-4-5-14-8-9/h1-6,8H,7H2
InChIKeyODBSHRBBPHTVIY-UHFFFAOYSA-N
MW208.26 g/mol
LogP3.47
Rot. Bonds3

About 3-[(3-fluorophenoxy)methyl]thiophene

3-[(3-fluorophenoxy)methyl]thiophene (PubChem CID 64763635) has the molecular formula C11H9FOS and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-[(3-fluorophenoxy)methyl]thiophene.

Molecular Properties

Compound Name3-[(3-fluorophenoxy)methyl]thiophene
PubChem CID64763635
Molecular FormulaC11H9FOS
Molecular Weight208.26 g/mol
Exact Mass208.04
IUPAC Name3-[(3-fluorophenoxy)methyl]thiophene
SMILESFc1cccc(OCc2ccsc2)c1
InChIInChI=1S/C11H9FOS/c12-10-2-1-3-11(6-10)13-7-9-4-5-14-8-9/h1-6,8H,7H2
InChIKeyODBSHRBBPHTVIY-UHFFFAOYSA-N
XLogP3.47
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[(3-fluorophenoxy)methyl]thiophene?
The IUPAC name of 3-[(3-fluorophenoxy)methyl]thiophene (CID 64763635) is 3-[(3-fluorophenoxy)methyl]thiophene.
What is the SMILES notation for 3-[(3-fluorophenoxy)methyl]thiophene?
The canonical SMILES for 3-[(3-fluorophenoxy)methyl]thiophene is Fc1cccc(OCc2ccsc2)c1.
What is the InChIKey of 3-[(3-fluorophenoxy)methyl]thiophene?
The InChIKey is ODBSHRBBPHTVIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FOS/c12-10-2-1-3-11(6-10)13-7-9-4-5-14-8-9/h1-6,8H,7H2.
What are the key properties of 3-[(3-fluorophenoxy)methyl]thiophene?
3-[(3-fluorophenoxy)methyl]thiophene has a molecular weight of 208.26 g/mol, XLogP of 3.47, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-fluorophenoxy)methyl]thiophene is sourced from PubChem (CID 64763635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).