2,3,4,5-tetraethylthiophene

C12H20S — CID 15260863

IUPAC2,3,4,5-tetraethylthiophene
SMILESCCc1sc(CC)c(CC)c1CC
InChIInChI=1S/C12H20S/c1-5-9-10(6-2)12(8-4)13-11(9)7-3/h5-8H2,1-4H3
InChIKeyJWGWXSHNLZYQHR-UHFFFAOYSA-N
MW196.36 g/mol
LogP4.00
Rot. Bonds4

About 2,3,4,5-tetraethylthiophene

2,3,4,5-tetraethylthiophene (PubChem CID 15260863) has the molecular formula C12H20S and a molecular weight of 196.36 g/mol. Its IUPAC name is 2,3,4,5-tetraethylthiophene.

Molecular Properties

Compound Name2,3,4,5-tetraethylthiophene
PubChem CID15260863
Molecular FormulaC12H20S
Molecular Weight196.36 g/mol
Exact Mass196.13
IUPAC Name2,3,4,5-tetraethylthiophene
SMILESCCc1sc(CC)c(CC)c1CC
InChIInChI=1S/C12H20S/c1-5-9-10(6-2)12(8-4)13-11(9)7-3/h5-8H2,1-4H3
InChIKeyJWGWXSHNLZYQHR-UHFFFAOYSA-N
XLogP4.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.36
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,3,4-Trimethylthiophene
CID 15710
2,3,4,5-Tetramethylthiophene
CID 139769
3-(Cyanomethyl)-2,4,5-trimethylthiophene
CID 14122208
5-Ethyl-2,3-dimethylthiophene
CID 528256
Octahydrodibenzothiophene
CID 265416
5-Butyl-2,3-dimethylthiophene
CID 528235
2,3-Dimethyl-5-propylthiophene
CID 528242
2-Butyl-3,5-dimethylthiophene
CID 528243
2-Ethyl-3,5-dimethylthiophene
CID 528249
3,5-Dimethyl-2-propylthiophene
CID 528254
Thiophene, 3,4-dibutyl-2-ethynyl-
CID 11138657
2,3,4,5-Tetrapropylthiophene
CID 14270410

Frequently Asked Questions

What is the IUPAC name of 2,3,4,5-tetraethylthiophene?
The IUPAC name of 2,3,4,5-tetraethylthiophene (CID 15260863) is 2,3,4,5-tetraethylthiophene.
What is the SMILES notation for 2,3,4,5-tetraethylthiophene?
The canonical SMILES for 2,3,4,5-tetraethylthiophene is CCc1sc(CC)c(CC)c1CC.
What is the InChIKey of 2,3,4,5-tetraethylthiophene?
The InChIKey is JWGWXSHNLZYQHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20S/c1-5-9-10(6-2)12(8-4)13-11(9)7-3/h5-8H2,1-4H3.
What are the key properties of 2,3,4,5-tetraethylthiophene?
2,3,4,5-tetraethylthiophene has a molecular weight of 196.36 g/mol, XLogP of 4.00, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetraethylthiophene is sourced from PubChem (CID 15260863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).