pentyl(selanylidene)phosphanium

C5H12PSe+ — CID 173256163

IUPACpentyl(selanylidene)phosphanium
SMILESCCCCC[PH+]=[Se]
InChIInChI=1S/C5H11PSe/c1-2-3-4-5-6-7/h2-5H2,1H3/p+1
InChIKeyLIAYREHSRLEFIK-UHFFFAOYSA-O
MW182.08 g/mol
LogP1.94
Rot. Bonds4

About pentyl(selanylidene)phosphanium

pentyl(selanylidene)phosphanium (PubChem CID 173256163) has the molecular formula C5H12PSe+ and a molecular weight of 182.08 g/mol. Its IUPAC name is pentyl(selanylidene)phosphanium.

Molecular Properties

Compound Namepentyl(selanylidene)phosphanium
PubChem CID173256163
Molecular FormulaC5H12PSe+
Molecular Weight182.08 g/mol
Exact Mass182.98
IUPAC Namepentyl(selanylidene)phosphanium
SMILESCCCCC[PH+]=[Se]
InChIInChI=1S/C5H11PSe/c1-2-3-4-5-6-7/h2-5H2,1H3/p+1
InChIKeyLIAYREHSRLEFIK-UHFFFAOYSA-O
XLogP1.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.08
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

potassium;hexane;hydroxide
CID 158076133
oxo(pentyl)phosphanium
CID 154082405
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782
hexane;tetrahydrate
CID 174107213
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
dohexacontane
CID 522644
hexane;molybdenum
CID 162092649
decane;heptane
CID 159049036
hexane;tetrahydrochloride
CID 18520801
henoctacontane
CID 22086342

Frequently Asked Questions

What is the IUPAC name of pentyl(selanylidene)phosphanium?
The IUPAC name of pentyl(selanylidene)phosphanium (CID 173256163) is pentyl(selanylidene)phosphanium.
What is the SMILES notation for pentyl(selanylidene)phosphanium?
The canonical SMILES for pentyl(selanylidene)phosphanium is CCCCC[PH+]=[Se].
What is the InChIKey of pentyl(selanylidene)phosphanium?
The InChIKey is LIAYREHSRLEFIK-UHFFFAOYSA-O. The full InChI is InChI=1S/C5H11PSe/c1-2-3-4-5-6-7/h2-5H2,1H3/p+1.
What are the key properties of pentyl(selanylidene)phosphanium?
pentyl(selanylidene)phosphanium has a molecular weight of 182.08 g/mol, XLogP of 1.94, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for pentyl(selanylidene)phosphanium is sourced from PubChem (CID 173256163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).