[(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol

C11H15O2P — CID 58582662

IUPAC[(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol
SMILESO=[P@@]1(c2ccccc2)CCC[C@@H]1CO
InChIInChI=1S/C11H15O2P/c12-9-11-7-4-8-14(11,13)10-5-2-1-3-6-10/h1-3,5-6,11-12H,4,7-9H2/t11-,14-/m1/s1
InChIKeyGEAKVSDAQGKLGS-BXUZGUMPSA-N
MW210.21 g/mol
LogP1.83
Rot. Bonds2

About [(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol

[(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol (PubChem CID 58582662) has the molecular formula C11H15O2P and a molecular weight of 210.21 g/mol. Its IUPAC name is [(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol.

Molecular Properties

Compound Name[(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol
PubChem CID58582662
Molecular FormulaC11H15O2P
Molecular Weight210.21 g/mol
Exact Mass210.08
IUPAC Name[(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol
SMILESO=[P@@]1(c2ccccc2)CCC[C@@H]1CO
InChIInChI=1S/C11H15O2P/c12-9-11-7-4-8-14(11,13)10-5-2-1-3-6-10/h1-3,5-6,11-12H,4,7-9H2/t11-,14-/m1/s1
InChIKeyGEAKVSDAQGKLGS-BXUZGUMPSA-N
XLogP1.83
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol?
The IUPAC name of [(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol (CID 58582662) is [(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol.
What is the SMILES notation for [(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol?
The canonical SMILES for [(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol is O=[P@@]1(c2ccccc2)CCC[C@@H]1CO.
What is the InChIKey of [(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol?
The InChIKey is GEAKVSDAQGKLGS-BXUZGUMPSA-N. The full InChI is InChI=1S/C11H15O2P/c12-9-11-7-4-8-14(11,13)10-5-2-1-3-6-10/h1-3,5-6,11-12H,4,7-9H2/t11-,14-/m1/s1.
What are the key properties of [(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol?
[(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol has a molecular weight of 210.21 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2R)-1-oxo-1-phenyl-1λ5-phospholan-2-yl]methanol is sourced from PubChem (CID 58582662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).