2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene

C11H9FS2 — CID 91241555

IUPAC2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene
SMILESC=CC(F)c1ccc(-c2cccs2)s1
InChIInChI=1S/C11H9FS2/c1-2-8(12)9-5-6-11(14-9)10-4-3-7-13-10/h2-8H,1H2
InChIKeyGJMGVSLSFMUEJE-UHFFFAOYSA-N
MW224.33 g/mol
LogP4.67
Rot. Bonds3

About 2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene

2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene (PubChem CID 91241555) has the molecular formula C11H9FS2 and a molecular weight of 224.33 g/mol. Its IUPAC name is 2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene.

Molecular Properties

Compound Name2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene
PubChem CID91241555
Molecular FormulaC11H9FS2
Molecular Weight224.33 g/mol
Exact Mass224.01
IUPAC Name2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene
SMILESC=CC(F)c1ccc(-c2cccs2)s1
InChIInChI=1S/C11H9FS2/c1-2-8(12)9-5-6-11(14-9)10-4-3-7-13-10/h2-8H,1H2
InChIKeyGJMGVSLSFMUEJE-UHFFFAOYSA-N
XLogP4.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene?
The IUPAC name of 2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene (CID 91241555) is 2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene.
What is the SMILES notation for 2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene?
The canonical SMILES for 2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene is C=CC(F)c1ccc(-c2cccs2)s1.
What is the InChIKey of 2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene?
The InChIKey is GJMGVSLSFMUEJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FS2/c1-2-8(12)9-5-6-11(14-9)10-4-3-7-13-10/h2-8H,1H2.
What are the key properties of 2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene?
2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene has a molecular weight of 224.33 g/mol, XLogP of 4.67, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-fluoroprop-2-enyl)-5-thiophen-2-ylthiophene is sourced from PubChem (CID 91241555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).