[(2R,3R)-2,3-diphenyloxiran-2-yl]methanol

C15H14O2 — CID 11356574

IUPAC[(2R,3R)-2,3-diphenyloxiran-2-yl]methanol
SMILESOC[C@@]1(c2ccccc2)O[C@@H]1c1ccccc1
InChIInChI=1S/C15H14O2/c16-11-15(13-9-5-2-6-10-13)14(17-15)12-7-3-1-4-8-12/h1-10,14,16H,11H2/t14-,15+/m1/s1
InChIKeyZEVYUFMALOLWIC-CABCVRRESA-N
MW226.28 g/mol
LogP2.65
Rot. Bonds3

About [(2R,3R)-2,3-diphenyloxiran-2-yl]methanol

[(2R,3R)-2,3-diphenyloxiran-2-yl]methanol (PubChem CID 11356574) has the molecular formula C15H14O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is [(2R,3R)-2,3-diphenyloxiran-2-yl]methanol.

Molecular Properties

Compound Name[(2R,3R)-2,3-diphenyloxiran-2-yl]methanol
PubChem CID11356574
Molecular FormulaC15H14O2
Molecular Weight226.28 g/mol
Exact Mass226.10
IUPAC Name[(2R,3R)-2,3-diphenyloxiran-2-yl]methanol
SMILESOC[C@@]1(c2ccccc2)O[C@@H]1c1ccccc1
InChIInChI=1S/C15H14O2/c16-11-15(13-9-5-2-6-10-13)14(17-15)12-7-3-1-4-8-12/h1-10,14,16H,11H2/t14-,15+/m1/s1
InChIKeyZEVYUFMALOLWIC-CABCVRRESA-N
XLogP2.65
TPSA32.76 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(2R,3R)-2,3-diphenyloxiran-2-yl]methanol?
The IUPAC name of [(2R,3R)-2,3-diphenyloxiran-2-yl]methanol (CID 11356574) is [(2R,3R)-2,3-diphenyloxiran-2-yl]methanol.
What is the SMILES notation for [(2R,3R)-2,3-diphenyloxiran-2-yl]methanol?
The canonical SMILES for [(2R,3R)-2,3-diphenyloxiran-2-yl]methanol is OC[C@@]1(c2ccccc2)O[C@@H]1c1ccccc1.
What is the InChIKey of [(2R,3R)-2,3-diphenyloxiran-2-yl]methanol?
The InChIKey is ZEVYUFMALOLWIC-CABCVRRESA-N. The full InChI is InChI=1S/C15H14O2/c16-11-15(13-9-5-2-6-10-13)14(17-15)12-7-3-1-4-8-12/h1-10,14,16H,11H2/t14-,15+/m1/s1.
What are the key properties of [(2R,3R)-2,3-diphenyloxiran-2-yl]methanol?
[(2R,3R)-2,3-diphenyloxiran-2-yl]methanol has a molecular weight of 226.28 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3R)-2,3-diphenyloxiran-2-yl]methanol is sourced from PubChem (CID 11356574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).