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

C15H16FO3P — CID 11860165

IUPAC(R)-[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol
SMILESCCO[P@](=O)(c1ccccc1)[C@@H](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/t15-,20-/m1/s1
InChIKeyCYFUKEROPIFLLI-FOIQADDNSA-N
MW294.26 g/mol
LogP3.46
Rot. Bonds5

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

(R)-[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol (PubChem CID 11860165) has the molecular formula C15H16FO3P and a molecular weight of 294.26 g/mol. Its IUPAC name is (R)-[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol.

Molecular Properties

Compound Name(R)-[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol
PubChem CID11860165
Molecular FormulaC15H16FO3P
Molecular Weight294.26 g/mol
Exact Mass294.08
IUPAC Name(R)-[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol
SMILESCCO[P@](=O)(c1ccccc1)[C@@H](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/t15-,20-/m1/s1
InChIKeyCYFUKEROPIFLLI-FOIQADDNSA-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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Related Compounds

ethoxy-[(4-fluorophenyl)-hydroxymethyl]phosphinic acid
CID 11042650
(R)-[ethoxy(2-phenylethynyl)phosphoryl]-(4-fluorophenyl)methanol
CID 11860854
2,2,2-trichloro-1-[ethoxy(phenyl)phosphoryl]ethanol
CID 46220815
1-[ethoxy(phenyl)phosphoryl]ethylbenzene
CID 11778094
(S)-[[4-(dimethylamino)phenyl]-ethoxyphosphoryl]-(4-methylphenyl)methanol
CID 11860745
[[(S)-diethoxyphosphoryl(fluoro)methyl]-ethoxyphosphoryl]benzene
CID 10449767
(2S)-2-[ethoxy(phenyl)phosphoryl]-1-phenylbutan-1-one
CID 11861697
(R)-[[4-(dimethylamino)phenyl]-propoxyphosphoryl]-phenylmethanol
CID 11863122
ethoxy-hydroxy-phenyl-sulfanylidene-λ5-phosphane;(1R)-1-(4-fluorophenyl)ethanamine
CID 11493867
1-[diethoxyphosphoryl-(4-fluorophenyl)methyl]-4-fluorobenzene
CID 10404973
N-[(R)-diethoxyphosphoryl(phenyl)methyl]-4-fluorobenzamide
CID 2324721
[ethoxy-[[ethoxy(phenyl)phosphoryl]-[ethoxy(phenyl)phosphoryl]sulfanylmethyl]phosphoryl]benzene
CID 23280723

Frequently Asked Questions

What is the IUPAC name of (R)-[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol?
The IUPAC name of (R)-[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol (CID 11860165) is (R)-[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol.
What is the SMILES notation for (R)-[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol?
The canonical SMILES for (R)-[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol is CCO[P@](=O)(c1ccccc1)[C@@H](O)c1ccc(F)cc1.
What is the InChIKey of (R)-[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol?
The InChIKey is CYFUKEROPIFLLI-FOIQADDNSA-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/t15-,20-/m1/s1.
What are the key properties of (R)-[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol?
(R)-[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 (R)-[ethoxy(phenyl)phosphoryl]-(4-fluorophenyl)methanol is sourced from PubChem (CID 11860165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).