2-[[ethoxy(phenoxy)phosphoryl]methyl]furan

C13H15O4P — CID 137470187

IUPAC2-[[ethoxy(phenoxy)phosphoryl]methyl]furan
SMILESCCOP(=O)(Cc1ccco1)Oc1ccccc1
InChIInChI=1S/C13H15O4P/c1-2-16-18(14,11-13-9-6-10-15-13)17-12-7-4-3-5-8-12/h3-10H,2,11H2,1H3
InChIKeyPCGWTCZOZWRVEK-UHFFFAOYSA-N
MW266.23 g/mol
LogP4.09
Rot. Bonds6

About 2-[[ethoxy(phenoxy)phosphoryl]methyl]furan

2-[[ethoxy(phenoxy)phosphoryl]methyl]furan (PubChem CID 137470187) has the molecular formula C13H15O4P and a molecular weight of 266.23 g/mol. Its IUPAC name is 2-[[ethoxy(phenoxy)phosphoryl]methyl]furan.

Molecular Properties

Compound Name2-[[ethoxy(phenoxy)phosphoryl]methyl]furan
PubChem CID137470187
Molecular FormulaC13H15O4P
Molecular Weight266.23 g/mol
Exact Mass266.07
IUPAC Name2-[[ethoxy(phenoxy)phosphoryl]methyl]furan
SMILESCCOP(=O)(Cc1ccco1)Oc1ccccc1
InChIInChI=1S/C13H15O4P/c1-2-16-18(14,11-13-9-6-10-15-13)17-12-7-4-3-5-8-12/h3-10H,2,11H2,1H3
InChIKeyPCGWTCZOZWRVEK-UHFFFAOYSA-N
XLogP4.09
TPSA48.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.23
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[chloromethyl(ethoxy)phosphoryl]oxybenzene
CID 71429135
1-[benzyl(ethoxy)phosphoryl]oxy-4-methoxybenzene
CID 137470189
[ethoxy(phenyl)phosphoryl]oxybenzene
CID 12735424
2-diethoxyphosphoryl-1-(furan-2-yl)ethanamine
CID 72796397
[2-diphenoxyphosphorylethyl(phenoxy)phosphoryl]oxybenzene
CID 14550387
[ethoxy(phenylsulfanyl)phosphoryl]oxybenzene
CID 67093206
(1S)-2-diethoxyphosphoryl-1-(furan-2-yl)ethanol
CID 11299626
1-(diethoxyphosphorylmethylsulfanyl)-4-phenoxybenzene
CID 134216339
2-(ethylperoxymethyl)furan
CID 175094388
[methoxy-[[methoxy(phenoxy)phosphoryl]methyl]phosphoryl]oxybenzene;dihydrate
CID 87979302
[2-dimethoxyphosphorylethyl(phenoxy)phosphoryl]oxybenzene
CID 132915786
diphenoxyphosphoryl diphenyl phosphate;propane
CID 162105616

Frequently Asked Questions

What is the IUPAC name of 2-[[ethoxy(phenoxy)phosphoryl]methyl]furan?
The IUPAC name of 2-[[ethoxy(phenoxy)phosphoryl]methyl]furan (CID 137470187) is 2-[[ethoxy(phenoxy)phosphoryl]methyl]furan.
What is the SMILES notation for 2-[[ethoxy(phenoxy)phosphoryl]methyl]furan?
The canonical SMILES for 2-[[ethoxy(phenoxy)phosphoryl]methyl]furan is CCOP(=O)(Cc1ccco1)Oc1ccccc1.
What is the InChIKey of 2-[[ethoxy(phenoxy)phosphoryl]methyl]furan?
The InChIKey is PCGWTCZOZWRVEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15O4P/c1-2-16-18(14,11-13-9-6-10-15-13)17-12-7-4-3-5-8-12/h3-10H,2,11H2,1H3.
What are the key properties of 2-[[ethoxy(phenoxy)phosphoryl]methyl]furan?
2-[[ethoxy(phenoxy)phosphoryl]methyl]furan has a molecular weight of 266.23 g/mol, XLogP of 4.09, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[ethoxy(phenoxy)phosphoryl]methyl]furan is sourced from PubChem (CID 137470187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).