5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol

C11H11F3OS2 — CID 115828390

IUPAC5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol
SMILESOC(CCCC(F)(F)F)c1cc2sccc2s1
InChIInChI=1S/C11H11F3OS2/c12-11(13,14)4-1-2-7(15)9-6-10-8(17-9)3-5-16-10/h3,5-7,15H,1-2,4H2
InChIKeyRJRGEPUFJLSVIG-UHFFFAOYSA-N
MW280.34 g/mol
LogP4.73
Rot. Bonds4

About 5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol

5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol (PubChem CID 115828390) has the molecular formula C11H11F3OS2 and a molecular weight of 280.34 g/mol. Its IUPAC name is 5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol.

Molecular Properties

Compound Name5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol
PubChem CID115828390
Molecular FormulaC11H11F3OS2
Molecular Weight280.34 g/mol
Exact Mass280.02
IUPAC Name5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol
SMILESOC(CCCC(F)(F)F)c1cc2sccc2s1
InChIInChI=1S/C11H11F3OS2/c12-11(13,14)4-1-2-7(15)9-6-10-8(17-9)3-5-16-10/h3,5-7,15H,1-2,4H2
InChIKeyRJRGEPUFJLSVIG-UHFFFAOYSA-N
XLogP4.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-1-thieno[3,2-b]thiophen-5-ylhexan-1-ol
CID 115830002
4,4,4-trifluoro-1-thieno[3,2-b]thiophen-5-ylbutan-1-amine
CID 104992946
1-thieno[3,2-b]thiophen-5-ylbutan-1-ol
CID 115780945
1-thieno[3,2-b]thiophen-5-yloctan-1-ol
CID 115783186
chloro(thieno[3,2-b]thiophen-5-yl)methanol
CID 123645090
5,5,5-trifluoro-1-(5-methylthiophen-2-yl)pentan-1-ol
CID 115515429
2-(4-chloro-3-fluorophenyl)-1-thieno[3,2-b]thiophen-5-ylethanol
CID 107894377
2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanol
CID 115826177
4,4-dimethyl-1-thieno[3,2-b]thiophen-5-ylpentan-1-amine
CID 115850208
(4-fluorophenyl)-thieno[3,2-b]thiophen-5-ylmethanol
CID 80745407
1-(4,5-dimethylthiophen-2-yl)-4,4,4-trifluorobutan-1-ol
CID 115808765
1-thieno[3,2-b]thiophen-5-ylbutylhydrazine
CID 105282348

Frequently Asked Questions

What is the IUPAC name of 5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol?
The IUPAC name of 5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol (CID 115828390) is 5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol.
What is the SMILES notation for 5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol?
The canonical SMILES for 5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol is OC(CCCC(F)(F)F)c1cc2sccc2s1.
What is the InChIKey of 5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol?
The InChIKey is RJRGEPUFJLSVIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3OS2/c12-11(13,14)4-1-2-7(15)9-6-10-8(17-9)3-5-16-10/h3,5-7,15H,1-2,4H2.
What are the key properties of 5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol?
5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol has a molecular weight of 280.34 g/mol, XLogP of 4.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,5-trifluoro-1-thieno[3,2-b]thiophen-5-ylpentan-1-ol is sourced from PubChem (CID 115828390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).