ethoxy-hexoxy-oxophosphanium

C8H18O3P+ — CID 6329155

IUPACethoxy-hexoxy-oxophosphanium
SMILESCCCCCCO[P+](=O)OCC
InChIInChI=1S/C8H18O3P/c1-3-5-6-7-8-11-12(9)10-4-2/h3-8H2,1-2H3/q+1
InChIKeyXZOFHBSPMGKSQM-UHFFFAOYSA-N
MW193.20 g/mol
LogP3.28
Rot. Bonds8

About ethoxy-hexoxy-oxophosphanium

ethoxy-hexoxy-oxophosphanium (PubChem CID 6329155) has the molecular formula C8H18O3P+ and a molecular weight of 193.20 g/mol. Its IUPAC name is ethoxy-hexoxy-oxophosphanium.

Molecular Properties

Compound Nameethoxy-hexoxy-oxophosphanium
PubChem CID6329155
Molecular FormulaC8H18O3P+
Molecular Weight193.20 g/mol
Exact Mass193.10
IUPAC Nameethoxy-hexoxy-oxophosphanium
SMILESCCCCCCO[P+](=O)OCC
InChIInChI=1S/C8H18O3P/c1-3-5-6-7-8-11-12(9)10-4-2/h3-8H2,1-2H3/q+1
InChIKeyXZOFHBSPMGKSQM-UHFFFAOYSA-N
XLogP3.28
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethoxy-oxo-pentoxyphosphanium
CID 86182061
dihexadecoxy(oxo)phosphanium
CID 6336657
oxo-di(tetradecoxy)phosphanium;tetradecane
CID 88815459
dioctadecoxy(oxo)phosphanium
CID 6327799
dodecoxy-octoxy-oxophosphanium
CID 154187352
butoxy-dodecoxy-oxophosphanium
CID 175103299
dioctoxy(oxo)phosphanium;zinc
CID 175522796
oxo(dipentoxy)phosphanium;zinc
CID 157360735
benzene;dihexoxy(oxo)phosphanium
CID 19391965
bis(N,N-dimethylmethanamine);ethoxy-[6-[ethoxy(oxo)phosphaniumyl]oxyhexoxy]-oxophosphanium
CID 87949359
2-(dimethylamino)ethoxy-dodecoxy-oxophosphanium
CID 169075510
2-[hexoxy(oxo)phosphaniumyl]oxyethyl-trimethylazanium
CID 174865096

Frequently Asked Questions

What is the IUPAC name of ethoxy-hexoxy-oxophosphanium?
The IUPAC name of ethoxy-hexoxy-oxophosphanium (CID 6329155) is ethoxy-hexoxy-oxophosphanium.
What is the SMILES notation for ethoxy-hexoxy-oxophosphanium?
The canonical SMILES for ethoxy-hexoxy-oxophosphanium is CCCCCCO[P+](=O)OCC.
What is the InChIKey of ethoxy-hexoxy-oxophosphanium?
The InChIKey is XZOFHBSPMGKSQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O3P/c1-3-5-6-7-8-11-12(9)10-4-2/h3-8H2,1-2H3/q+1.
What are the key properties of ethoxy-hexoxy-oxophosphanium?
ethoxy-hexoxy-oxophosphanium has a molecular weight of 193.20 g/mol, XLogP of 3.28, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-hexoxy-oxophosphanium is sourced from PubChem (CID 6329155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).