2-[diethoxyphosphoryl(ethoxy)methyl]furan

C11H19O5P — CID 71381055

IUPAC2-[diethoxyphosphoryl(ethoxy)methyl]furan
SMILESCCOC(c1ccco1)P(=O)(OCC)OCC
InChIInChI=1S/C11H19O5P/c1-4-13-11(10-8-7-9-14-10)17(12,15-5-2)16-6-3/h7-9,11H,4-6H2,1-3H3
InChIKeyJPUCXLJGFRQXEY-UHFFFAOYSA-N
MW262.24 g/mol
LogP3.58
Rot. Bonds8

About 2-[diethoxyphosphoryl(ethoxy)methyl]furan

2-[diethoxyphosphoryl(ethoxy)methyl]furan (PubChem CID 71381055) has the molecular formula C11H19O5P and a molecular weight of 262.24 g/mol. Its IUPAC name is 2-[diethoxyphosphoryl(ethoxy)methyl]furan.

Molecular Properties

Compound Name2-[diethoxyphosphoryl(ethoxy)methyl]furan
PubChem CID71381055
Molecular FormulaC11H19O5P
Molecular Weight262.24 g/mol
Exact Mass262.10
IUPAC Name2-[diethoxyphosphoryl(ethoxy)methyl]furan
SMILESCCOC(c1ccco1)P(=O)(OCC)OCC
InChIInChI=1S/C11H19O5P/c1-4-13-11(10-8-7-9-14-10)17(12,15-5-2)16-6-3/h7-9,11H,4-6H2,1-3H3
InChIKeyJPUCXLJGFRQXEY-UHFFFAOYSA-N
XLogP3.58
TPSA57.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.24
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[diethoxyphosphoryl(furan-2-yl)methoxy]-5,5-dimethyl-1,3,2-dioxarsinane
CID 23412694
diethyl 2-[diethoxyphosphoryl(furan-2-yl)methyl]propanedioate;hydrate
CID 52997745
N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine
CID 11278792
2-diethoxyphosphoryl-1-(furan-2-yl)ethanamine
CID 72796397
(1S)-2-diethoxyphosphoryl-1-(furan-2-yl)ethanol
CID 11299626
N-[(R)-diethoxyphosphoryl(furan-2-yl)methyl]-6-methylpyridin-1-ium-2-amine
CID 7323424
2-(dipropoxymethyl)furan
CID 14296431
ethyl 2-diethoxyphosphoryl-3-(furan-2-yl)-3-oxopropanoate
CID 10591620
2-(1,2-diethoxyethyl)furan
CID 566398
[(1S)-4-chloro-4-diethoxyphosphoryl-1-(furan-2-yl)-3-oxobutyl] butanoate
CID 23421874
2,2-diethoxy-N-[(1S)-1-(furan-2-yl)ethyl]ethanamine
CID 81400852
[diethoxyphosphoryl(phenylselanyl)methyl]selanylbenzene
CID 11059605

Frequently Asked Questions

What is the IUPAC name of 2-[diethoxyphosphoryl(ethoxy)methyl]furan?
The IUPAC name of 2-[diethoxyphosphoryl(ethoxy)methyl]furan (CID 71381055) is 2-[diethoxyphosphoryl(ethoxy)methyl]furan.
What is the SMILES notation for 2-[diethoxyphosphoryl(ethoxy)methyl]furan?
The canonical SMILES for 2-[diethoxyphosphoryl(ethoxy)methyl]furan is CCOC(c1ccco1)P(=O)(OCC)OCC.
What is the InChIKey of 2-[diethoxyphosphoryl(ethoxy)methyl]furan?
The InChIKey is JPUCXLJGFRQXEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19O5P/c1-4-13-11(10-8-7-9-14-10)17(12,15-5-2)16-6-3/h7-9,11H,4-6H2,1-3H3.
What are the key properties of 2-[diethoxyphosphoryl(ethoxy)methyl]furan?
2-[diethoxyphosphoryl(ethoxy)methyl]furan has a molecular weight of 262.24 g/mol, XLogP of 3.58, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[diethoxyphosphoryl(ethoxy)methyl]furan is sourced from PubChem (CID 71381055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).