2-(5-benzylfuran-3-yl)ethanol

C13H14O2 — CID 67742011

IUPAC2-(5-benzylfuran-3-yl)ethanol
SMILESOCCc1coc(Cc2ccccc2)c1
InChIInChI=1S/C13H14O2/c14-7-6-12-9-13(15-10-12)8-11-4-2-1-3-5-11/h1-5,9-10,14H,6-8H2
InChIKeyNEPJRYBXHNCTJP-UHFFFAOYSA-N
MW202.25 g/mol
LogP2.41
Rot. Bonds4

About 2-(5-benzylfuran-3-yl)ethanol

2-(5-benzylfuran-3-yl)ethanol (PubChem CID 67742011) has the molecular formula C13H14O2 and a molecular weight of 202.25 g/mol. Its IUPAC name is 2-(5-benzylfuran-3-yl)ethanol.

Molecular Properties

Compound Name2-(5-benzylfuran-3-yl)ethanol
PubChem CID67742011
Molecular FormulaC13H14O2
Molecular Weight202.25 g/mol
Exact Mass202.10
IUPAC Name2-(5-benzylfuran-3-yl)ethanol
SMILESOCCc1coc(Cc2ccccc2)c1
InChIInChI=1S/C13H14O2/c14-7-6-12-9-13(15-10-12)8-11-4-2-1-3-5-11/h1-5,9-10,14H,6-8H2
InChIKeyNEPJRYBXHNCTJP-UHFFFAOYSA-N
XLogP2.41
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5-benzylfuran-3-yl)ethanol?
The IUPAC name of 2-(5-benzylfuran-3-yl)ethanol (CID 67742011) is 2-(5-benzylfuran-3-yl)ethanol.
What is the SMILES notation for 2-(5-benzylfuran-3-yl)ethanol?
The canonical SMILES for 2-(5-benzylfuran-3-yl)ethanol is OCCc1coc(Cc2ccccc2)c1.
What is the InChIKey of 2-(5-benzylfuran-3-yl)ethanol?
The InChIKey is NEPJRYBXHNCTJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O2/c14-7-6-12-9-13(15-10-12)8-11-4-2-1-3-5-11/h1-5,9-10,14H,6-8H2.
What are the key properties of 2-(5-benzylfuran-3-yl)ethanol?
2-(5-benzylfuran-3-yl)ethanol has a molecular weight of 202.25 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-benzylfuran-3-yl)ethanol is sourced from PubChem (CID 67742011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).