3-ethyl-4-methoxythiophene

C7H10OS — CID 19099079

IUPAC3-ethyl-4-methoxythiophene
SMILESCCc1cscc1OC
InChIInChI=1S/C7H10OS/c1-3-6-4-9-5-7(6)8-2/h4-5H,3H2,1-2H3
InChIKeyOERNGHXVZHWZLB-UHFFFAOYSA-N
MW142.22 g/mol
LogP2.32
Rot. Bonds2

About 3-ethyl-4-methoxythiophene

3-ethyl-4-methoxythiophene (PubChem CID 19099079) has the molecular formula C7H10OS and a molecular weight of 142.22 g/mol. Its IUPAC name is 3-ethyl-4-methoxythiophene.

Molecular Properties

Compound Name3-ethyl-4-methoxythiophene
PubChem CID19099079
Molecular FormulaC7H10OS
Molecular Weight142.22 g/mol
Exact Mass142.05
IUPAC Name3-ethyl-4-methoxythiophene
SMILESCCc1cscc1OC
InChIInChI=1S/C7H10OS/c1-3-6-4-9-5-7(6)8-2/h4-5H,3H2,1-2H3
InChIKeyOERNGHXVZHWZLB-UHFFFAOYSA-N
XLogP2.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.22
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-methoxythiophene?
The IUPAC name of 3-ethyl-4-methoxythiophene (CID 19099079) is 3-ethyl-4-methoxythiophene.
What is the SMILES notation for 3-ethyl-4-methoxythiophene?
The canonical SMILES for 3-ethyl-4-methoxythiophene is CCc1cscc1OC.
What is the InChIKey of 3-ethyl-4-methoxythiophene?
The InChIKey is OERNGHXVZHWZLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10OS/c1-3-6-4-9-5-7(6)8-2/h4-5H,3H2,1-2H3.
What are the key properties of 3-ethyl-4-methoxythiophene?
3-ethyl-4-methoxythiophene has a molecular weight of 142.22 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-methoxythiophene is sourced from PubChem (CID 19099079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).