[2-(oxolan-2-yl)phenyl]methanol

C11H14O2 — CID 156806092

IUPAC[2-(oxolan-2-yl)phenyl]methanol
SMILESOCc1ccccc1C1CCCO1
InChIInChI=1S/C11H14O2/c12-8-9-4-1-2-5-10(9)11-6-3-7-13-11/h1-2,4-5,11-12H,3,6-8H2
InChIKeyXSJIQBUKJLYECN-UHFFFAOYSA-N
MW178.23 g/mol
LogP2.03
Rot. Bonds2

About [2-(oxolan-2-yl)phenyl]methanol

[2-(oxolan-2-yl)phenyl]methanol (PubChem CID 156806092) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is [2-(oxolan-2-yl)phenyl]methanol.

Molecular Properties

Compound Name[2-(oxolan-2-yl)phenyl]methanol
PubChem CID156806092
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name[2-(oxolan-2-yl)phenyl]methanol
SMILESOCc1ccccc1C1CCCO1
InChIInChI=1S/C11H14O2/c12-8-9-4-1-2-5-10(9)11-6-3-7-13-11/h1-2,4-5,11-12H,3,6-8H2
InChIKeyXSJIQBUKJLYECN-UHFFFAOYSA-N
XLogP2.03
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 ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(oxolan-2-yl)phenyl]methanol?
The IUPAC name of [2-(oxolan-2-yl)phenyl]methanol (CID 156806092) is [2-(oxolan-2-yl)phenyl]methanol.
What is the SMILES notation for [2-(oxolan-2-yl)phenyl]methanol?
The canonical SMILES for [2-(oxolan-2-yl)phenyl]methanol is OCc1ccccc1C1CCCO1.
What is the InChIKey of [2-(oxolan-2-yl)phenyl]methanol?
The InChIKey is XSJIQBUKJLYECN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c12-8-9-4-1-2-5-10(9)11-6-3-7-13-11/h1-2,4-5,11-12H,3,6-8H2.
What are the key properties of [2-(oxolan-2-yl)phenyl]methanol?
[2-(oxolan-2-yl)phenyl]methanol has a molecular weight of 178.23 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(oxolan-2-yl)phenyl]methanol is sourced from PubChem (CID 156806092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).