2-ethyl-5-methoxythieno[3,2-b]thiophene

C9H10OS2 — CID 91191349

IUPAC2-ethyl-5-methoxythieno[3,2-b]thiophene
SMILESCCc1cc2sc(OC)cc2s1
InChIInChI=1S/C9H10OS2/c1-3-6-4-7-8(11-6)5-9(10-2)12-7/h4-5H,3H2,1-2H3
InChIKeyDVZFETNBMMDZFG-UHFFFAOYSA-N
MW198.31 g/mol
LogP3.53
Rot. Bonds2

About 2-ethyl-5-methoxythieno[3,2-b]thiophene

2-ethyl-5-methoxythieno[3,2-b]thiophene (PubChem CID 91191349) has the molecular formula C9H10OS2 and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-ethyl-5-methoxythieno[3,2-b]thiophene.

Molecular Properties

Compound Name2-ethyl-5-methoxythieno[3,2-b]thiophene
PubChem CID91191349
Molecular FormulaC9H10OS2
Molecular Weight198.31 g/mol
Exact Mass198.02
IUPAC Name2-ethyl-5-methoxythieno[3,2-b]thiophene
SMILESCCc1cc2sc(OC)cc2s1
InChIInChI=1S/C9H10OS2/c1-3-6-4-7-8(11-6)5-9(10-2)12-7/h4-5H,3H2,1-2H3
InChIKeyDVZFETNBMMDZFG-UHFFFAOYSA-N
XLogP3.53
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-methoxythieno[3,2-b]thiophene?
The IUPAC name of 2-ethyl-5-methoxythieno[3,2-b]thiophene (CID 91191349) is 2-ethyl-5-methoxythieno[3,2-b]thiophene.
What is the SMILES notation for 2-ethyl-5-methoxythieno[3,2-b]thiophene?
The canonical SMILES for 2-ethyl-5-methoxythieno[3,2-b]thiophene is CCc1cc2sc(OC)cc2s1.
What is the InChIKey of 2-ethyl-5-methoxythieno[3,2-b]thiophene?
The InChIKey is DVZFETNBMMDZFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10OS2/c1-3-6-4-7-8(11-6)5-9(10-2)12-7/h4-5H,3H2,1-2H3.
What are the key properties of 2-ethyl-5-methoxythieno[3,2-b]thiophene?
2-ethyl-5-methoxythieno[3,2-b]thiophene has a molecular weight of 198.31 g/mol, XLogP of 3.53, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-methoxythieno[3,2-b]thiophene is sourced from PubChem (CID 91191349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).