2,5-dithiophen-2-ylthieno[3,2-b]thiophene

C14H8S4 — CID 11738270

IUPAC2,5-dithiophen-2-ylthieno[3,2-b]thiophene
SMILESc1csc(-c2cc3sc(-c4cccs4)cc3s2)c1
InChIInChI=1S/C14H8S4/c1-3-9(15-5-1)11-7-13-14(17-11)8-12(18-13)10-4-2-6-16-10/h1-8H
InChIKeyFDQXVHKNZBLBFY-UHFFFAOYSA-N
MW304.49 g/mol
LogP6.42
Rot. Bonds2

About 2,5-dithiophen-2-ylthieno[3,2-b]thiophene

2,5-dithiophen-2-ylthieno[3,2-b]thiophene (PubChem CID 11738270) has the molecular formula C14H8S4 and a molecular weight of 304.49 g/mol. Its IUPAC name is 2,5-dithiophen-2-ylthieno[3,2-b]thiophene.

Molecular Properties

Compound Name2,5-dithiophen-2-ylthieno[3,2-b]thiophene
PubChem CID11738270
Molecular FormulaC14H8S4
Molecular Weight304.49 g/mol
Exact Mass303.95
IUPAC Name2,5-dithiophen-2-ylthieno[3,2-b]thiophene
SMILESc1csc(-c2cc3sc(-c4cccs4)cc3s2)c1
InChIInChI=1S/C14H8S4/c1-3-9(15-5-1)11-7-13-14(17-11)8-12(18-13)10-4-2-6-16-10/h1-8H
InChIKeyFDQXVHKNZBLBFY-UHFFFAOYSA-N
XLogP6.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.49
LogP ≤ 56.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,5-dithiophen-2-ylthieno[3,2-b]thiophene?
The IUPAC name of 2,5-dithiophen-2-ylthieno[3,2-b]thiophene (CID 11738270) is 2,5-dithiophen-2-ylthieno[3,2-b]thiophene.
What is the SMILES notation for 2,5-dithiophen-2-ylthieno[3,2-b]thiophene?
The canonical SMILES for 2,5-dithiophen-2-ylthieno[3,2-b]thiophene is c1csc(-c2cc3sc(-c4cccs4)cc3s2)c1.
What is the InChIKey of 2,5-dithiophen-2-ylthieno[3,2-b]thiophene?
The InChIKey is FDQXVHKNZBLBFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8S4/c1-3-9(15-5-1)11-7-13-14(17-11)8-12(18-13)10-4-2-6-16-10/h1-8H.
What are the key properties of 2,5-dithiophen-2-ylthieno[3,2-b]thiophene?
2,5-dithiophen-2-ylthieno[3,2-b]thiophene has a molecular weight of 304.49 g/mol, XLogP of 6.42, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dithiophen-2-ylthieno[3,2-b]thiophene is sourced from PubChem (CID 11738270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).