2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol

C13H12OS — CID 129319610

IUPAC2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol
SMILESOCCC1c2ccccc2-c2cscc21
InChIInChI=1S/C13H12OS/c14-6-5-11-9-3-1-2-4-10(9)12-7-15-8-13(11)12/h1-4,7-8,11,14H,5-6H2
InChIKeyMZUKZVGCSFZCNX-UHFFFAOYSA-N
MW216.31 g/mol
LogP3.24
Rot. Bonds2

About 2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol

2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol (PubChem CID 129319610) has the molecular formula C13H12OS and a molecular weight of 216.31 g/mol. Its IUPAC name is 2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol.

Molecular Properties

Compound Name2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol
PubChem CID129319610
Molecular FormulaC13H12OS
Molecular Weight216.31 g/mol
Exact Mass216.06
IUPAC Name2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol
SMILESOCCC1c2ccccc2-c2cscc21
InChIInChI=1S/C13H12OS/c14-6-5-11-9-3-1-2-4-10(9)12-7-15-8-13(11)12/h1-4,7-8,11,14H,5-6H2
InChIKeyMZUKZVGCSFZCNX-UHFFFAOYSA-N
XLogP3.24
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.31
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol?
The IUPAC name of 2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol (CID 129319610) is 2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol.
What is the SMILES notation for 2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol?
The canonical SMILES for 2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol is OCCC1c2ccccc2-c2cscc21.
What is the InChIKey of 2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol?
The InChIKey is MZUKZVGCSFZCNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12OS/c14-6-5-11-9-3-1-2-4-10(9)12-7-15-8-13(11)12/h1-4,7-8,11,14H,5-6H2.
What are the key properties of 2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol?
2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol has a molecular weight of 216.31 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4H-indeno[2,3-c]thiophen-4-yl)ethanol is sourced from PubChem (CID 129319610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).