cyclodecyl(triphenyl)phosphanium

C28H34P+ — CID 156526903

IUPACcyclodecyl(triphenyl)phosphanium
SMILESc1ccc([P+](c2ccccc2)(c2ccccc2)C2CCCCCCCCC2)cc1
InChIInChI=1S/C28H34P/c1-2-4-9-17-25(18-10-5-3-1)29(26-19-11-6-12-20-26,27-21-13-7-14-22-27)28-23-15-8-16-24-28/h6-8,11-16,19-25H,1-5,9-10,17-18H2/q+1
InChIKeyMKVIEWWKGQWPDW-UHFFFAOYSA-N
MW401.55 g/mol
LogP6.87
Rot. Bonds4

About cyclodecyl(triphenyl)phosphanium

cyclodecyl(triphenyl)phosphanium (PubChem CID 156526903) has the molecular formula C28H34P+ and a molecular weight of 401.55 g/mol. Its IUPAC name is cyclodecyl(triphenyl)phosphanium.

Molecular Properties

Compound Namecyclodecyl(triphenyl)phosphanium
PubChem CID156526903
Molecular FormulaC28H34P+
Molecular Weight401.55 g/mol
Exact Mass401.24
IUPAC Namecyclodecyl(triphenyl)phosphanium
SMILESc1ccc([P+](c2ccccc2)(c2ccccc2)C2CCCCCCCCC2)cc1
InChIInChI=1S/C28H34P/c1-2-4-9-17-25(18-10-5-3-1)29(26-19-11-6-12-20-26,27-21-13-7-14-22-27)28-23-15-8-16-24-28/h6-8,11-16,19-25H,1-5,9-10,17-18H2/q+1
InChIKeyMKVIEWWKGQWPDW-UHFFFAOYSA-N
XLogP6.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500401.55
LogP ≤ 56.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze cyclodecyl(triphenyl)phosphanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cyclohexyl(triphenyl)phosphanium chloride
CID 18407754
cyclopentyl(triphenyl)phosphanium;phosphane;iodide
CID 174786242
cyclohexyl-methyl-diphenylphosphanium
CID 23418239
cyclopentyl-methyl-diphenylphosphanium
CID 23413005
2-[cyclohexyl(diphenyl)phosphaniumyl]-4-hydroxynaphthalen-1-olate
CID 58591777
cyclohexyl-(2,2-difluoroethyl)-diphenylphosphanium
CID 132552925
triphenyl-(4-triphenylphosphaniumylcyclohex-2-en-1-yl)phosphanium
CID 11083310
cyclopentyl(triphenyl)phosphanium;heptanoate
CID 19082498
(3,4-dimethylcyclohex-3-en-1-yl)-triphenylphosphanium
CID 6333489
triphenyl-(4-triphenylphosphaniumylcyclohex-2-en-1-yl)phosphanium dibromide
CID 11147088
cyclobutyl(triphenyl)phosphanium;heptanoate
CID 19082518
CID 166445594
CID 166445594

Frequently Asked Questions

What is the IUPAC name of cyclodecyl(triphenyl)phosphanium?
The IUPAC name of cyclodecyl(triphenyl)phosphanium (CID 156526903) is cyclodecyl(triphenyl)phosphanium.
What is the SMILES notation for cyclodecyl(triphenyl)phosphanium?
The canonical SMILES for cyclodecyl(triphenyl)phosphanium is c1ccc([P+](c2ccccc2)(c2ccccc2)C2CCCCCCCCC2)cc1.
What is the InChIKey of cyclodecyl(triphenyl)phosphanium?
The InChIKey is MKVIEWWKGQWPDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H34P/c1-2-4-9-17-25(18-10-5-3-1)29(26-19-11-6-12-20-26,27-21-13-7-14-22-27)28-23-15-8-16-24-28/h6-8,11-16,19-25H,1-5,9-10,17-18H2/q+1.
What are the key properties of cyclodecyl(triphenyl)phosphanium?
cyclodecyl(triphenyl)phosphanium has a molecular weight of 401.55 g/mol, XLogP of 6.87, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclodecyl(triphenyl)phosphanium is sourced from PubChem (CID 156526903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).