(3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol

C11H12O2 — CID 129411804

IUPAC(3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol
SMILESO[C@@H]1C=C[C@H](c2ccccc2)OC1
InChIInChI=1S/C11H12O2/c12-10-6-7-11(13-8-10)9-4-2-1-3-5-9/h1-7,10-12H,8H2/t10-,11-/m1/s1
InChIKeyFDIAOCGHOBNZJH-GHMZBOCLSA-N
MW176.22 g/mol
LogP1.67
Rot. Bonds1

About (3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol

(3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol (PubChem CID 129411804) has the molecular formula C11H12O2 and a molecular weight of 176.22 g/mol. Its IUPAC name is (3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol.

Molecular Properties

Compound Name(3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol
PubChem CID129411804
Molecular FormulaC11H12O2
Molecular Weight176.22 g/mol
Exact Mass176.08
IUPAC Name(3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol
SMILESO[C@@H]1C=C[C@H](c2ccccc2)OC1
InChIInChI=1S/C11H12O2/c12-10-6-7-11(13-8-10)9-4-2-1-3-5-9/h1-7,10-12H,8H2/t10-,11-/m1/s1
InChIKeyFDIAOCGHOBNZJH-GHMZBOCLSA-N
XLogP1.67
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

[(3S,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-yl] acetate
CID 102226049
(3S,6R)-6-phenylmethoxy-3,6-dihydro-2H-pyran-3-ol
CID 11275756
2-phenyloxirane
CID 7276
7-phenyl-2,3,4,7-tetrahydrooxepine
CID 56628699
(8aS)-2-phenyl-4a,7,8,8a-tetrahydro-4H-1,3-benzodioxin-7-ol
CID 58388646
(3S,5R)-5-phenyloxolan-3-ol
CID 97052112
2-phenyl-1,3-dioxolan-4-ol
CID 23288237
(4S,5R)-4-[(4S,5R)-5-hydroxy-2-phenyl-1,3-dioxan-4-yl]-2-phenyl-1,3-dioxan-5-ol
CID 90322628
(2S,3S)-2-phenyl-3,6-dihydro-2H-pyran-3-ol
CID 23245881
(4S,5R)-4-[(4R,5S)-5-hydroxy-2-phenyl-1,3-dioxan-4-yl]-2-phenyl-1,3-dioxan-5-ol
CID 102461331
(4S,5S)-4-[(4S,5S)-5-hydroxy-2-phenyl-1,3-dioxan-4-yl]-2-phenyl-1,3-dioxan-5-ol
CID 176837277
(5R)-4-[(4R,5R)-5-hydroxy-2-phenyl-1,3-dioxan-4-yl]-2-phenyl-1,3-dioxan-5-ol
CID 22309099

Frequently Asked Questions

What is the IUPAC name of (3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol?
The IUPAC name of (3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol (CID 129411804) is (3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol.
What is the SMILES notation for (3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol?
The canonical SMILES for (3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol is O[C@@H]1C=C[C@H](c2ccccc2)OC1.
What is the InChIKey of (3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol?
The InChIKey is FDIAOCGHOBNZJH-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H12O2/c12-10-6-7-11(13-8-10)9-4-2-1-3-5-9/h1-7,10-12H,8H2/t10-,11-/m1/s1.
What are the key properties of (3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol?
(3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol has a molecular weight of 176.22 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,6R)-6-phenyl-3,6-dihydro-2H-pyran-3-ol is sourced from PubChem (CID 129411804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).