ethenyl-octoxy-oxophosphanium

C10H20O2P+ — CID 175403597

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

About ethenyl-octoxy-oxophosphanium

ethenyl-octoxy-oxophosphanium (PubChem CID 175403597) has the molecular formula C10H20O2P+ and a molecular weight of 203.24 g/mol. Its IUPAC name is ethenyl-octoxy-oxophosphanium.

Molecular Properties

Compound Nameethenyl-octoxy-oxophosphanium
PubChem CID175403597
Molecular FormulaC10H20O2P+
Molecular Weight203.24 g/mol
Exact Mass203.12
IUPAC Nameethenyl-octoxy-oxophosphanium
SMILESC=C[P+](=O)OCCCCCCCC
InChIInChI=1S/C10H20O2P/c1-3-5-6-7-8-9-10-12-13(11)4-2/h4H,2-3,5-10H2,1H3/q+1
InChIKeyFBWXHCZJEKRLQL-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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

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
bis(dodecoxy-oxido-oxophosphanium);iron(2+)
CID 87602903
oxido-oxo-tetracosoxyphosphanium
CID 57352033
oxo(dipentoxy)phosphanium;zinc
CID 157360735
nonoxy-oxo-propylphosphanium
CID 174923561
calcium bis(octoxy-oxido-oxophosphanium)
CID 57351629
azane;hexoxy-hydroxy-oxophosphanium
CID 174618925

Frequently Asked Questions

What is the IUPAC name of ethenyl-octoxy-oxophosphanium?
The IUPAC name of ethenyl-octoxy-oxophosphanium (CID 175403597) is ethenyl-octoxy-oxophosphanium.
What is the SMILES notation for ethenyl-octoxy-oxophosphanium?
The canonical SMILES for ethenyl-octoxy-oxophosphanium is C=C[P+](=O)OCCCCCCCC.
What is the InChIKey of ethenyl-octoxy-oxophosphanium?
The InChIKey is FBWXHCZJEKRLQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2P/c1-3-5-6-7-8-9-10-12-13(11)4-2/h4H,2-3,5-10H2,1H3/q+1.
What are the key properties of ethenyl-octoxy-oxophosphanium?
ethenyl-octoxy-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 ethenyl-octoxy-oxophosphanium is sourced from PubChem (CID 175403597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).