2-(2,3-dihydrothiophen-5-yl)ethanol

C6H10OS — CID 89343424

IUPAC2-(2,3-dihydrothiophen-5-yl)ethanol
SMILESOCCC1=CCCS1
InChIInChI=1S/C6H10OS/c7-4-3-6-2-1-5-8-6/h2,7H,1,3-5H2
InChIKeyRYRBHNMAORMHSA-UHFFFAOYSA-N
MW130.21 g/mol
LogP1.39
Rot. Bonds2

About 2-(2,3-dihydrothiophen-5-yl)ethanol

2-(2,3-dihydrothiophen-5-yl)ethanol (PubChem CID 89343424) has the molecular formula C6H10OS and a molecular weight of 130.21 g/mol. Its IUPAC name is 2-(2,3-dihydrothiophen-5-yl)ethanol.

Molecular Properties

Compound Name2-(2,3-dihydrothiophen-5-yl)ethanol
PubChem CID89343424
Molecular FormulaC6H10OS
Molecular Weight130.21 g/mol
Exact Mass130.05
IUPAC Name2-(2,3-dihydrothiophen-5-yl)ethanol
SMILESOCCC1=CCCS1
InChIInChI=1S/C6H10OS/c7-4-3-6-2-1-5-8-6/h2,7H,1,3-5H2
InChIKeyRYRBHNMAORMHSA-UHFFFAOYSA-N
XLogP1.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.21
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydrothiophen-5-yl)ethanol?
The IUPAC name of 2-(2,3-dihydrothiophen-5-yl)ethanol (CID 89343424) is 2-(2,3-dihydrothiophen-5-yl)ethanol.
What is the SMILES notation for 2-(2,3-dihydrothiophen-5-yl)ethanol?
The canonical SMILES for 2-(2,3-dihydrothiophen-5-yl)ethanol is OCCC1=CCCS1.
What is the InChIKey of 2-(2,3-dihydrothiophen-5-yl)ethanol?
The InChIKey is RYRBHNMAORMHSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10OS/c7-4-3-6-2-1-5-8-6/h2,7H,1,3-5H2.
What are the key properties of 2-(2,3-dihydrothiophen-5-yl)ethanol?
2-(2,3-dihydrothiophen-5-yl)ethanol has a molecular weight of 130.21 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydrothiophen-5-yl)ethanol is sourced from PubChem (CID 89343424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).