ethenoxy-octyl-oxophosphanium

C10H20O2P+ — CID 175403596

IUPACethenoxy-octyl-oxophosphanium
SMILESC=CO[P+](=O)CCCCCCCC
InChIInChI=1S/C10H20O2P/c1-3-5-6-7-8-9-10-13(11)12-4-2/h4H,2-3,5-10H2,1H3/q+1
InChIKeyYDTDIWPSKIBEEL-UHFFFAOYSA-N
MW203.24 g/mol
LogP4.25
Rot. Bonds9

About ethenoxy-octyl-oxophosphanium

ethenoxy-octyl-oxophosphanium (PubChem CID 175403596) has the molecular formula C10H20O2P+ and a molecular weight of 203.24 g/mol. Its IUPAC name is ethenoxy-octyl-oxophosphanium.

Molecular Properties

Compound Nameethenoxy-octyl-oxophosphanium
PubChem CID175403596
Molecular FormulaC10H20O2P+
Molecular Weight203.24 g/mol
Exact Mass203.12
IUPAC Nameethenoxy-octyl-oxophosphanium
SMILESC=CO[P+](=O)CCCCCCCC
InChIInChI=1S/C10H20O2P/c1-3-5-6-7-8-9-10-13(11)12-4-2/h4H,2-3,5-10H2,1H3/q+1
InChIKeyYDTDIWPSKIBEEL-UHFFFAOYSA-N
XLogP4.25
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

ethoxy-octyl-oxophosphanium
CID 14512429
neodymium;octoxy-octyl-oxophosphanium
CID 174731713
decyl(triethyl)azanium;ethenoxy-oxido-oxophosphanium
CID 174475382
hept-6-enyl-oxo-propoxyphosphanium
CID 176901774
hexyl-(2-methylpropoxy)-oxophosphanium
CID 88827543
butyl-heptoxy-oxophosphanium
CID 22497580
ethenyl-octoxy-oxophosphanium
CID 175403597
2-[dodecyl(oxo)phosphaniumyl]oxyethyl-trimethylazanium
CID 20977395
hexyl-oxo-phenoxyphosphanium
CID 67135564
ethenoxyethene;hexane;hydrate
CID 175235648
dimethoxy(oxo)phosphanium;octadec-1-ene
CID 19391966
decane;ruthenium
CID 160818595

Frequently Asked Questions

What is the IUPAC name of ethenoxy-octyl-oxophosphanium?
The IUPAC name of ethenoxy-octyl-oxophosphanium (CID 175403596) is ethenoxy-octyl-oxophosphanium.
What is the SMILES notation for ethenoxy-octyl-oxophosphanium?
The canonical SMILES for ethenoxy-octyl-oxophosphanium is C=CO[P+](=O)CCCCCCCC.
What is the InChIKey of ethenoxy-octyl-oxophosphanium?
The InChIKey is YDTDIWPSKIBEEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2P/c1-3-5-6-7-8-9-10-13(11)12-4-2/h4H,2-3,5-10H2,1H3/q+1.
What are the key properties of ethenoxy-octyl-oxophosphanium?
ethenoxy-octyl-oxophosphanium has a molecular weight of 203.24 g/mol, XLogP of 4.25, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenoxy-octyl-oxophosphanium is sourced from PubChem (CID 175403596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).