4,4-dinaphthalen-1-ylbutylphosphane

C24H23P — CID 141348188

IUPAC4,4-dinaphthalen-1-ylbutylphosphane
SMILESPCCCC(c1cccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C24H23P/c25-17-7-16-24(22-14-5-10-18-8-1-3-12-20(18)22)23-15-6-11-19-9-2-4-13-21(19)23/h1-6,8-15,24H,7,16-17,25H2
InChIKeyQWVFZNXYSFFQQO-UHFFFAOYSA-N
MW342.42 g/mol
LogP6.78
Rot. Bonds5

About 4,4-dinaphthalen-1-ylbutylphosphane

4,4-dinaphthalen-1-ylbutylphosphane (PubChem CID 141348188) has the molecular formula C24H23P and a molecular weight of 342.42 g/mol. Its IUPAC name is 4,4-dinaphthalen-1-ylbutylphosphane.

Molecular Properties

Compound Name4,4-dinaphthalen-1-ylbutylphosphane
PubChem CID141348188
Molecular FormulaC24H23P
Molecular Weight342.42 g/mol
Exact Mass342.15
IUPAC Name4,4-dinaphthalen-1-ylbutylphosphane
SMILESPCCCC(c1cccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C24H23P/c25-17-7-16-24(22-14-5-10-18-8-1-3-12-20(18)22)23-15-6-11-19-9-2-4-13-21(19)23/h1-6,8-15,24H,7,16-17,25H2
InChIKeyQWVFZNXYSFFQQO-UHFFFAOYSA-N
XLogP6.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.42
LogP ≤ 56.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4,4-dinaphthalen-1-ylbutylphosphane?
The IUPAC name of 4,4-dinaphthalen-1-ylbutylphosphane (CID 141348188) is 4,4-dinaphthalen-1-ylbutylphosphane.
What is the SMILES notation for 4,4-dinaphthalen-1-ylbutylphosphane?
The canonical SMILES for 4,4-dinaphthalen-1-ylbutylphosphane is PCCCC(c1cccc2ccccc12)c1cccc2ccccc12.
What is the InChIKey of 4,4-dinaphthalen-1-ylbutylphosphane?
The InChIKey is QWVFZNXYSFFQQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23P/c25-17-7-16-24(22-14-5-10-18-8-1-3-12-20(18)22)23-15-6-11-19-9-2-4-13-21(19)23/h1-6,8-15,24H,7,16-17,25H2.
What are the key properties of 4,4-dinaphthalen-1-ylbutylphosphane?
4,4-dinaphthalen-1-ylbutylphosphane has a molecular weight of 342.42 g/mol, XLogP of 6.78, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dinaphthalen-1-ylbutylphosphane is sourced from PubChem (CID 141348188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).