[3-(oxolan-3-yl)phenyl]methanol

C11H14O2 — CID 84656521

IUPAC[3-(oxolan-3-yl)phenyl]methanol
SMILESOCc1cccc(C2CCOC2)c1
InChIInChI=1S/C11H14O2/c12-7-9-2-1-3-10(6-9)11-4-5-13-8-11/h1-3,6,11-12H,4-5,7-8H2
InChIKeyMDRNIJCAIVQCLA-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.68
Rot. Bonds2

About [3-(oxolan-3-yl)phenyl]methanol

[3-(oxolan-3-yl)phenyl]methanol (PubChem CID 84656521) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is [3-(oxolan-3-yl)phenyl]methanol.

Molecular Properties

Compound Name[3-(oxolan-3-yl)phenyl]methanol
PubChem CID84656521
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name[3-(oxolan-3-yl)phenyl]methanol
SMILESOCc1cccc(C2CCOC2)c1
InChIInChI=1S/C11H14O2/c12-7-9-2-1-3-10(6-9)11-4-5-13-8-11/h1-3,6,11-12H,4-5,7-8H2
InChIKeyMDRNIJCAIVQCLA-UHFFFAOYSA-N
XLogP1.68
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-(oxolan-3-yl)phenyl]methanol?
The IUPAC name of [3-(oxolan-3-yl)phenyl]methanol (CID 84656521) is [3-(oxolan-3-yl)phenyl]methanol.
What is the SMILES notation for [3-(oxolan-3-yl)phenyl]methanol?
The canonical SMILES for [3-(oxolan-3-yl)phenyl]methanol is OCc1cccc(C2CCOC2)c1.
What is the InChIKey of [3-(oxolan-3-yl)phenyl]methanol?
The InChIKey is MDRNIJCAIVQCLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c12-7-9-2-1-3-10(6-9)11-4-5-13-8-11/h1-3,6,11-12H,4-5,7-8H2.
What are the key properties of [3-(oxolan-3-yl)phenyl]methanol?
[3-(oxolan-3-yl)phenyl]methanol has a molecular weight of 178.23 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(oxolan-3-yl)phenyl]methanol is sourced from PubChem (CID 84656521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).