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

C6H10OS — CID 20623011

IUPAC2-(2,5-dihydrothiophen-3-yl)ethanol
SMILESOCCC1=CCSC1
InChIInChI=1S/C6H10OS/c7-3-1-6-2-4-8-5-6/h2,7H,1,3-5H2
InChIKeyWIDFUYMNYPMMHR-UHFFFAOYSA-N
MW130.21 g/mol
LogP1.04
Rot. Bonds2

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

2-(2,5-dihydrothiophen-3-yl)ethanol (PubChem CID 20623011) has the molecular formula C6H10OS and a molecular weight of 130.21 g/mol. Its IUPAC name is 2-(2,5-dihydrothiophen-3-yl)ethanol.

Molecular Properties

Compound Name2-(2,5-dihydrothiophen-3-yl)ethanol
PubChem CID20623011
Molecular FormulaC6H10OS
Molecular Weight130.21 g/mol
Exact Mass130.05
IUPAC Name2-(2,5-dihydrothiophen-3-yl)ethanol
SMILESOCCC1=CCSC1
InChIInChI=1S/C6H10OS/c7-3-1-6-2-4-8-5-6/h2,7H,1,3-5H2
InChIKeyWIDFUYMNYPMMHR-UHFFFAOYSA-N
XLogP1.04
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 ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2,2-Dimethyl-2,5-dihydrothiophen-3-yl)methanol
CID 130127735
2,5-Dihydro-2-thiophenemethanol
CID 12589175
2-Hydroxymethyl-4-methyl-2,5-dihydrothiophene
CID 12589176
2-Hydroxymethyl-5-methyl-2,5-dihydrothiophene
CID 12589177
(5,5-dimethyl-2H-thiophen-3-yl)methanol
CID 19003454
2-(1,1-Dioxo-2,5-dihydrothiophen-3-yl)ethanol
CID 20622989
(2-methyl-3,5-dihydro-2H-thiophen-3-id-5-yl)methanol;yttrium
CID 60011711
[(5S)-2-methyl-3,5-dihydro-2H-thiophen-3-id-5-yl]methanol;yttrium
CID 60030282
(5-Methyl-2,3-dihydrothiophen-2-yl)methanol
CID 68051007
2-(2,3-Dihydrothiophen-5-yl)ethanol
CID 89343424
2-(5-methyl-2-prop-1-en-2-yl-2H-thiophen-5-yl)ethanol
CID 118437143
2-(5-methyl-2H-thiophen-5-yl)ethanol
CID 118437192

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dihydrothiophen-3-yl)ethanol?
The IUPAC name of 2-(2,5-dihydrothiophen-3-yl)ethanol (CID 20623011) is 2-(2,5-dihydrothiophen-3-yl)ethanol.
What is the SMILES notation for 2-(2,5-dihydrothiophen-3-yl)ethanol?
The canonical SMILES for 2-(2,5-dihydrothiophen-3-yl)ethanol is OCCC1=CCSC1.
What is the InChIKey of 2-(2,5-dihydrothiophen-3-yl)ethanol?
The InChIKey is WIDFUYMNYPMMHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10OS/c7-3-1-6-2-4-8-5-6/h2,7H,1,3-5H2.
What are the key properties of 2-(2,5-dihydrothiophen-3-yl)ethanol?
2-(2,5-dihydrothiophen-3-yl)ethanol has a molecular weight of 130.21 g/mol, XLogP of 1.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dihydrothiophen-3-yl)ethanol is sourced from PubChem (CID 20623011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).