bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium

C8H20O7P3+ — CID 155345155

IUPACbis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium
SMILESCCOP(=O)(CC)O[P+](=O)OP(=O)(CC)OCC
InChIInChI=1S/C8H20O7P3/c1-5-12-17(10,7-3)14-16(9)15-18(11,8-4)13-6-2/h5-8H2,1-4H3/q+1
InChIKeyWMXHPAJYLHQTKY-UHFFFAOYSA-N
MW321.16 g/mol
LogP4.18
Rot. Bonds10

About bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium

bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium (PubChem CID 155345155) has the molecular formula C8H20O7P3+ and a molecular weight of 321.16 g/mol. Its IUPAC name is bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium.

Molecular Properties

Compound Namebis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium
PubChem CID155345155
Molecular FormulaC8H20O7P3+
Molecular Weight321.16 g/mol
Exact Mass321.04
IUPAC Namebis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium
SMILESCCOP(=O)(CC)O[P+](=O)OP(=O)(CC)OCC
InChIInChI=1S/C8H20O7P3/c1-5-12-17(10,7-3)14-16(9)15-18(11,8-4)13-6-2/h5-8H2,1-4H3/q+1
InChIKeyWMXHPAJYLHQTKY-UHFFFAOYSA-N
XLogP4.18
TPSA88.13 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.16
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[ethoxy(ethyl)phosphoryl] hypochlorite
CID 87057693
1-[ethyl(methylsulfinylmethoxy)phosphoryl]oxyethane
CID 57178539
[ethoxy(ethyl)phosphoryl]oxymethylcyclopropane
CID 87083673
1-[ethoxy(ethyl)phosphoryl]oxyheptane
CID 88847628
1-[ethoxy(methoxymethyl)phosphoryl]oxyethane
CID 11658394
sodium diethoxyphosphorylmethanol
CID 22274944
carbonochloridic acid;[ethoxy(ethyl)phosphoryl]oxymethanol
CID 88813503
3-[ethoxy(ethyl)phosphoryl]oxy-2,2-dimethylbutane
CID 170850874
2-[ethoxy(ethyl)phosphoryl]oxyoxirane
CID 57290698
[ethyl(methoxy)phosphoryl]oxy-hydroxy-oxophosphanium
CID 168867703
N-(diethoxyphosphorylmethyl)propan-2-amine
CID 12633666
diethyl hydrogen phosphate;sulfane
CID 88774651

Frequently Asked Questions

What is the IUPAC name of bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium?
The IUPAC name of bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium (CID 155345155) is bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium.
What is the SMILES notation for bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium?
The canonical SMILES for bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium is CCOP(=O)(CC)O[P+](=O)OP(=O)(CC)OCC.
What is the InChIKey of bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium?
The InChIKey is WMXHPAJYLHQTKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20O7P3/c1-5-12-17(10,7-3)14-16(9)15-18(11,8-4)13-6-2/h5-8H2,1-4H3/q+1.
What are the key properties of bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium?
bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium has a molecular weight of 321.16 g/mol, XLogP of 4.18, 10 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for bis[[ethoxy(ethyl)phosphoryl]oxy]-oxophosphanium is sourced from PubChem (CID 155345155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).