(2R,3S)-2-benzyloxolan-3-ol

C11H14O2 — CID 139587651

IUPAC(2R,3S)-2-benzyloxolan-3-ol
SMILESO[C@H]1CCO[C@@H]1Cc1ccccc1
InChIInChI=1S/C11H14O2/c12-10-6-7-13-11(10)8-9-4-2-1-3-5-9/h1-5,10-12H,6-8H2/t10-,11+/m0/s1
InChIKeyYJXMOZYTZIZNQG-WDEREUQCSA-N
MW178.23 g/mol
LogP1.38
Rot. Bonds2

About (2R,3S)-2-benzyloxolan-3-ol

(2R,3S)-2-benzyloxolan-3-ol (PubChem CID 139587651) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is (2R,3S)-2-benzyloxolan-3-ol.

Molecular Properties

Compound Name(2R,3S)-2-benzyloxolan-3-ol
PubChem CID139587651
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name(2R,3S)-2-benzyloxolan-3-ol
SMILESO[C@H]1CCO[C@@H]1Cc1ccccc1
InChIInChI=1S/C11H14O2/c12-10-6-7-13-11(10)8-9-4-2-1-3-5-9/h1-5,10-12H,6-8H2/t10-,11+/m0/s1
InChIKeyYJXMOZYTZIZNQG-WDEREUQCSA-N
XLogP1.38
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 ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2R,3S)-2-benzyloxolan-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2-benzyloxolan-3-ol?
The IUPAC name of (2R,3S)-2-benzyloxolan-3-ol (CID 139587651) is (2R,3S)-2-benzyloxolan-3-ol.
What is the SMILES notation for (2R,3S)-2-benzyloxolan-3-ol?
The canonical SMILES for (2R,3S)-2-benzyloxolan-3-ol is O[C@H]1CCO[C@@H]1Cc1ccccc1.
What is the InChIKey of (2R,3S)-2-benzyloxolan-3-ol?
The InChIKey is YJXMOZYTZIZNQG-WDEREUQCSA-N. The full InChI is InChI=1S/C11H14O2/c12-10-6-7-13-11(10)8-9-4-2-1-3-5-9/h1-5,10-12H,6-8H2/t10-,11+/m0/s1.
What are the key properties of (2R,3S)-2-benzyloxolan-3-ol?
(2R,3S)-2-benzyloxolan-3-ol has a molecular weight of 178.23 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2-benzyloxolan-3-ol is sourced from PubChem (CID 139587651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).