3,4-dimethylthieno[2,3-b]thiophene

C8H8S2 — CID 2820119

IUPAC3,4-dimethylthieno[2,3-b]thiophene
SMILESCc1csc2scc(C)c12
InChIInChI=1S/C8H8S2/c1-5-3-9-8-7(5)6(2)4-10-8/h3-4H,1-2H3
InChIKeyRSRGJNXSXWLXTD-UHFFFAOYSA-N
MW168.29 g/mol
LogP3.58
Rot. Bonds

About 3,4-dimethylthieno[2,3-b]thiophene

3,4-dimethylthieno[2,3-b]thiophene (PubChem CID 2820119) has the molecular formula C8H8S2 and a molecular weight of 168.29 g/mol. Its IUPAC name is 3,4-dimethylthieno[2,3-b]thiophene.

Molecular Properties

Compound Name3,4-dimethylthieno[2,3-b]thiophene
PubChem CID2820119
Molecular FormulaC8H8S2
Molecular Weight168.29 g/mol
Exact Mass168.01
IUPAC Name3,4-dimethylthieno[2,3-b]thiophene
SMILESCc1csc2scc(C)c12
InChIInChI=1S/C8H8S2/c1-5-3-9-8-7(5)6(2)4-10-8/h3-4H,1-2H3
InChIKeyRSRGJNXSXWLXTD-UHFFFAOYSA-N
XLogP3.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.29
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethylthieno[2,3-b]thiophene?
The IUPAC name of 3,4-dimethylthieno[2,3-b]thiophene (CID 2820119) is 3,4-dimethylthieno[2,3-b]thiophene.
What is the SMILES notation for 3,4-dimethylthieno[2,3-b]thiophene?
The canonical SMILES for 3,4-dimethylthieno[2,3-b]thiophene is Cc1csc2scc(C)c12.
What is the InChIKey of 3,4-dimethylthieno[2,3-b]thiophene?
The InChIKey is RSRGJNXSXWLXTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8S2/c1-5-3-9-8-7(5)6(2)4-10-8/h3-4H,1-2H3.
What are the key properties of 3,4-dimethylthieno[2,3-b]thiophene?
3,4-dimethylthieno[2,3-b]thiophene has a molecular weight of 168.29 g/mol, XLogP of 3.58, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethylthieno[2,3-b]thiophene is sourced from PubChem (CID 2820119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).