[2-(hydroxymethyl)thiophen-3-yl]methanol

C6H8O2S — CID 14001706

IUPAC[2-(hydroxymethyl)thiophen-3-yl]methanol
SMILESOCc1ccsc1CO
InChIInChI=1S/C6H8O2S/c7-3-5-1-2-9-6(5)4-8/h1-2,7-8H,3-4H2
InChIKeySUVOAAWORTVNEP-UHFFFAOYSA-N
MW144.19 g/mol
LogP0.73
Rot. Bonds2

About [2-(hydroxymethyl)thiophen-3-yl]methanol

[2-(hydroxymethyl)thiophen-3-yl]methanol (PubChem CID 14001706) has the molecular formula C6H8O2S and a molecular weight of 144.19 g/mol. Its IUPAC name is [2-(hydroxymethyl)thiophen-3-yl]methanol.

Molecular Properties

Compound Name[2-(hydroxymethyl)thiophen-3-yl]methanol
PubChem CID14001706
Molecular FormulaC6H8O2S
Molecular Weight144.19 g/mol
Exact Mass144.02
IUPAC Name[2-(hydroxymethyl)thiophen-3-yl]methanol
SMILESOCc1ccsc1CO
InChIInChI=1S/C6H8O2S/c7-3-5-1-2-9-6(5)4-8/h1-2,7-8H,3-4H2
InChIKeySUVOAAWORTVNEP-UHFFFAOYSA-N
XLogP0.73
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.19
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(hydroxymethyl)thiophen-3-yl]methanol?
The IUPAC name of [2-(hydroxymethyl)thiophen-3-yl]methanol (CID 14001706) is [2-(hydroxymethyl)thiophen-3-yl]methanol.
What is the SMILES notation for [2-(hydroxymethyl)thiophen-3-yl]methanol?
The canonical SMILES for [2-(hydroxymethyl)thiophen-3-yl]methanol is OCc1ccsc1CO.
What is the InChIKey of [2-(hydroxymethyl)thiophen-3-yl]methanol?
The InChIKey is SUVOAAWORTVNEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O2S/c7-3-5-1-2-9-6(5)4-8/h1-2,7-8H,3-4H2.
What are the key properties of [2-(hydroxymethyl)thiophen-3-yl]methanol?
[2-(hydroxymethyl)thiophen-3-yl]methanol has a molecular weight of 144.19 g/mol, XLogP of 0.73, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(hydroxymethyl)thiophen-3-yl]methanol is sourced from PubChem (CID 14001706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).