tetrakis(pent-3-enyl)phosphanium

C20H36P+ — CID 154314281

IUPACtetrakis(pent-3-enyl)phosphanium
SMILESCC=CCC[P+](CCC=CC)(CCC=CC)CCC=CC
InChIInChI=1S/C20H36P/c1-5-9-13-17-21(18-14-10-6-2,19-15-11-7-3)20-16-12-8-4/h5-12H,13-20H2,1-4H3/q+1
InChIKeyMNQATMWETDJNMQ-UHFFFAOYSA-N
MW307.48 g/mol
LogP6.87
Rot. Bonds12

About tetrakis(pent-3-enyl)phosphanium

tetrakis(pent-3-enyl)phosphanium (PubChem CID 154314281) has the molecular formula C20H36P+ and a molecular weight of 307.48 g/mol. Its IUPAC name is tetrakis(pent-3-enyl)phosphanium.

Molecular Properties

Compound Nametetrakis(pent-3-enyl)phosphanium
PubChem CID154314281
Molecular FormulaC20H36P+
Molecular Weight307.48 g/mol
Exact Mass307.25
IUPAC Nametetrakis(pent-3-enyl)phosphanium
SMILESCC=CCC[P+](CCC=CC)(CCC=CC)CCC=CC
InChIInChI=1S/C20H36P/c1-5-9-13-17-21(18-14-10-6-2,19-15-11-7-3)20-16-12-8-4/h5-12H,13-20H2,1-4H3/q+1
InChIKeyMNQATMWETDJNMQ-UHFFFAOYSA-N
XLogP6.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500307.48
LogP ≤ 56.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

hept-5-en-2-amine
CID 72784707
6,7-dimethyloct-2-ene
CID 54205493
tetrakis(hept-3-enyl)phosphanium
CID 154264399
(2E,6Z,10E)-dodeca-2,6,10-triene
CID 12503721
hexatriaconta-2,6,10,14,18,22,26,30,34-nonaene
CID 154144745
(2E,6E,10E,14E,18E,22E)-tetracosa-2,6,10,14,18,22-hexaene
CID 57417215
(6E)-3-methylocta-1,6-diene
CID 14140905
6-methylnon-2-ene
CID 21361194
(E)-3-methyloct-6-en-1-ol
CID 14091580
tetrakis(oct-3-enyl)phosphanium
CID 154360446
2-methylnon-7-en-4-ol
CID 71320713
2-ethylhept-5-enal
CID 159875666

Frequently Asked Questions

What is the IUPAC name of tetrakis(pent-3-enyl)phosphanium?
The IUPAC name of tetrakis(pent-3-enyl)phosphanium (CID 154314281) is tetrakis(pent-3-enyl)phosphanium.
What is the SMILES notation for tetrakis(pent-3-enyl)phosphanium?
The canonical SMILES for tetrakis(pent-3-enyl)phosphanium is CC=CCC[P+](CCC=CC)(CCC=CC)CCC=CC.
What is the InChIKey of tetrakis(pent-3-enyl)phosphanium?
The InChIKey is MNQATMWETDJNMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H36P/c1-5-9-13-17-21(18-14-10-6-2,19-15-11-7-3)20-16-12-8-4/h5-12H,13-20H2,1-4H3/q+1.
What are the key properties of tetrakis(pent-3-enyl)phosphanium?
tetrakis(pent-3-enyl)phosphanium has a molecular weight of 307.48 g/mol, XLogP of 6.87, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(pent-3-enyl)phosphanium is sourced from PubChem (CID 154314281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).