undec-1-enyl(undec-1-enylphosphanyl)phosphane

C22H44P2 — CID 90919459

IUPACundec-1-enyl(undec-1-enylphosphanyl)phosphane
SMILESCCCCCCCCCC=CPPC=CCCCCCCCCC
InChIInChI=1S/C22H44P2/c1-3-5-7-9-11-13-15-17-19-21-23-24-22-20-18-16-14-12-10-8-6-4-2/h19-24H,3-18H2,1-2H3
InChIKeySTIRKRQVWBHPCO-UHFFFAOYSA-N
MW370.54 g/mol
LogP9.57
Rot. Bonds19

About undec-1-enyl(undec-1-enylphosphanyl)phosphane

undec-1-enyl(undec-1-enylphosphanyl)phosphane (PubChem CID 90919459) has the molecular formula C22H44P2 and a molecular weight of 370.54 g/mol. Its IUPAC name is undec-1-enyl(undec-1-enylphosphanyl)phosphane.

Molecular Properties

Compound Nameundec-1-enyl(undec-1-enylphosphanyl)phosphane
PubChem CID90919459
Molecular FormulaC22H44P2
Molecular Weight370.54 g/mol
Exact Mass370.29
IUPAC Nameundec-1-enyl(undec-1-enylphosphanyl)phosphane
SMILESCCCCCCCCCC=CPPC=CCCCCCCCCC
InChIInChI=1S/C22H44P2/c1-3-5-7-9-11-13-15-17-19-21-23-24-22-20-18-16-14-12-10-8-6-4-2/h19-24H,3-18H2,1-2H3
InChIKeySTIRKRQVWBHPCO-UHFFFAOYSA-N
XLogP9.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds19
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.54
LogP ≤ 59.57
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'}

Analyze undec-1-enyl(undec-1-enylphosphanyl)phosphane 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

bis[(E)-triacont-1-enyl]phosphane
CID 21096765
bis[(E)-dodec-1-enyl]phosphane
CID 21096723
nonacos-7-ene
CID 71381021
(Z)-triacont-9-ene
CID 57484178
hexacont-21-ene
CID 54293076
pentacos-9-ene
CID 25201650
(Z)-heptadec-8-ene
CID 5352243
(E)-hexadec-6-ene
CID 5352260
(Z)-docos-9-ene
CID 11690102
(E)-hexacos-10-ene
CID 22172169
(E)-nonacos-10-ene
CID 14367300
triacont-12-ene
CID 54535715

Frequently Asked Questions

What is the IUPAC name of undec-1-enyl(undec-1-enylphosphanyl)phosphane?
The IUPAC name of undec-1-enyl(undec-1-enylphosphanyl)phosphane (CID 90919459) is undec-1-enyl(undec-1-enylphosphanyl)phosphane.
What is the SMILES notation for undec-1-enyl(undec-1-enylphosphanyl)phosphane?
The canonical SMILES for undec-1-enyl(undec-1-enylphosphanyl)phosphane is CCCCCCCCCC=CPPC=CCCCCCCCCC.
What is the InChIKey of undec-1-enyl(undec-1-enylphosphanyl)phosphane?
The InChIKey is STIRKRQVWBHPCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H44P2/c1-3-5-7-9-11-13-15-17-19-21-23-24-22-20-18-16-14-12-10-8-6-4-2/h19-24H,3-18H2,1-2H3.
What are the key properties of undec-1-enyl(undec-1-enylphosphanyl)phosphane?
undec-1-enyl(undec-1-enylphosphanyl)phosphane has a molecular weight of 370.54 g/mol, XLogP of 9.57, 19 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for undec-1-enyl(undec-1-enylphosphanyl)phosphane is sourced from PubChem (CID 90919459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).