triethyl(pentyl)phosphanium

C11H26P+ — CID 18769294

IUPACtriethyl(pentyl)phosphanium
SMILESCCCCC[P+](CC)(CC)CC
InChIInChI=1S/C11H26P/c1-5-9-10-11-12(6-2,7-3)8-4/h5-11H2,1-4H3/q+1
InChIKeyRGXJWHBYXNYHML-UHFFFAOYSA-N
MW189.30 g/mol
LogP4.25
Rot. Bonds7

About triethyl(pentyl)phosphanium

triethyl(pentyl)phosphanium (PubChem CID 18769294) has the molecular formula C11H26P+ and a molecular weight of 189.30 g/mol. Its IUPAC name is triethyl(pentyl)phosphanium.

Molecular Properties

Compound Nametriethyl(pentyl)phosphanium
PubChem CID18769294
Molecular FormulaC11H26P+
Molecular Weight189.30 g/mol
Exact Mass189.18
IUPAC Nametriethyl(pentyl)phosphanium
SMILESCCCCC[P+](CC)(CC)CC
InChIInChI=1S/C11H26P/c1-5-9-10-11-12(6-2,7-3)8-4/h5-11H2,1-4H3/q+1
InChIKeyRGXJWHBYXNYHML-UHFFFAOYSA-N
XLogP4.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triethyl(pentyl)phosphanium?
The IUPAC name of triethyl(pentyl)phosphanium (CID 18769294) is triethyl(pentyl)phosphanium.
What is the SMILES notation for triethyl(pentyl)phosphanium?
The canonical SMILES for triethyl(pentyl)phosphanium is CCCCC[P+](CC)(CC)CC.
What is the InChIKey of triethyl(pentyl)phosphanium?
The InChIKey is RGXJWHBYXNYHML-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26P/c1-5-9-10-11-12(6-2,7-3)8-4/h5-11H2,1-4H3/q+1.
What are the key properties of triethyl(pentyl)phosphanium?
triethyl(pentyl)phosphanium has a molecular weight of 189.30 g/mol, XLogP of 4.25, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(pentyl)phosphanium is sourced from PubChem (CID 18769294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).