[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol

C15H16FO3P — CID 2909852

IUPAC[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol
SMILESCCOP(=O)(c1ccccc1)C(O)c1ccc(F)cc1
InChIInChI=1S/C15H16FO3P/c1-2-19-20(18,14-6-4-3-5-7-14)15(17)12-8-10-13(16)11-9-12/h3-11,15,17H,2H2,1H3
InChIKeyCYFUKEROPIFLLI-UHFFFAOYSA-N
MW294.26 g/mol
LogP3.46
Rot. Bonds5

About [ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol

[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol (PubChem CID 2909852) has the molecular formula C15H16FO3P and a molecular weight of 294.26 g/mol. Its IUPAC name is [ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol.

Molecular Properties

Compound Name[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol
PubChem CID2909852
Molecular FormulaC15H16FO3P
Molecular Weight294.26 g/mol
Exact Mass294.08
IUPAC Name[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol
SMILESCCOP(=O)(c1ccccc1)C(O)c1ccc(F)cc1
InChIInChI=1S/C15H16FO3P/c1-2-19-20(18,14-6-4-3-5-7-14)15(17)12-8-10-13(16)11-9-12/h3-11,15,17H,2H2,1H3
InChIKeyCYFUKEROPIFLLI-UHFFFAOYSA-N
XLogP3.46
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.26
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol?
The IUPAC name of [ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol (CID 2909852) is [ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol.
What is the SMILES notation for [ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol?
The canonical SMILES for [ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol is CCOP(=O)(c1ccccc1)C(O)c1ccc(F)cc1.
What is the InChIKey of [ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol?
The InChIKey is CYFUKEROPIFLLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FO3P/c1-2-19-20(18,14-6-4-3-5-7-14)15(17)12-8-10-13(16)11-9-12/h3-11,15,17H,2H2,1H3.
What are the key properties of [ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol?
[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol has a molecular weight of 294.26 g/mol, XLogP of 3.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol is sourced from PubChem (CID 2909852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).