3-(4-thiophen-3-ylphenyl)thiophene

C14H10S2 — CID 91665249

IUPAC3-(4-thiophen-3-ylphenyl)thiophene
SMILESc1cc(-c2ccc(-c3ccsc3)cc2)cs1
InChIInChI=1S/C14H10S2/c1-2-12(14-6-8-16-10-14)4-3-11(1)13-5-7-15-9-13/h1-10H
InChIKeyWTCJNWRAJYMGKI-UHFFFAOYSA-N
MW242.37 g/mol
LogP5.14
Rot. Bonds2

About 3-(4-thiophen-3-ylphenyl)thiophene

3-(4-thiophen-3-ylphenyl)thiophene (PubChem CID 91665249) has the molecular formula C14H10S2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 3-(4-thiophen-3-ylphenyl)thiophene.

Molecular Properties

Compound Name3-(4-thiophen-3-ylphenyl)thiophene
PubChem CID91665249
Molecular FormulaC14H10S2
Molecular Weight242.37 g/mol
Exact Mass242.02
IUPAC Name3-(4-thiophen-3-ylphenyl)thiophene
SMILESc1cc(-c2ccc(-c3ccsc3)cc2)cs1
InChIInChI=1S/C14H10S2/c1-2-12(14-6-8-16-10-14)4-3-11(1)13-5-7-15-9-13/h1-10H
InChIKeyWTCJNWRAJYMGKI-UHFFFAOYSA-N
XLogP5.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500242.37
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-thiophen-3-ylphenyl)thiophene?
The IUPAC name of 3-(4-thiophen-3-ylphenyl)thiophene (CID 91665249) is 3-(4-thiophen-3-ylphenyl)thiophene.
What is the SMILES notation for 3-(4-thiophen-3-ylphenyl)thiophene?
The canonical SMILES for 3-(4-thiophen-3-ylphenyl)thiophene is c1cc(-c2ccc(-c3ccsc3)cc2)cs1.
What is the InChIKey of 3-(4-thiophen-3-ylphenyl)thiophene?
The InChIKey is WTCJNWRAJYMGKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10S2/c1-2-12(14-6-8-16-10-14)4-3-11(1)13-5-7-15-9-13/h1-10H.
What are the key properties of 3-(4-thiophen-3-ylphenyl)thiophene?
3-(4-thiophen-3-ylphenyl)thiophene has a molecular weight of 242.37 g/mol, XLogP of 5.14, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-thiophen-3-ylphenyl)thiophene is sourced from PubChem (CID 91665249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).