lithium dinaphthalen-1-ylphosphinate

C20H14LiO2P — CID 141248266

IUPAClithium dinaphthalen-1-ylphosphinate
SMILESO=P([O-])(c1cccc2ccccc12)c1cccc2ccccc12.[Li+]
InChIInChI=1S/C20H15O2P.Li/c21-23(22,19-13-5-9-15-7-1-3-11-17(15)19)20-14-6-10-16-8-2-4-12-18(16)20;/h1-14H,(H,21,22);/q;+1/p-1
InChIKeyWAXZNMXNNRJCQY-UHFFFAOYSA-M
MW324.25 g/mol
LogP0.59
Rot. Bonds2

About lithium dinaphthalen-1-ylphosphinate

lithium dinaphthalen-1-ylphosphinate (PubChem CID 141248266) has the molecular formula C20H14LiO2P and a molecular weight of 324.25 g/mol. Its IUPAC name is lithium dinaphthalen-1-ylphosphinate.

Molecular Properties

Compound Namelithium dinaphthalen-1-ylphosphinate
PubChem CID141248266
Molecular FormulaC20H14LiO2P
Molecular Weight324.25 g/mol
Exact Mass324.09
IUPAC Namelithium dinaphthalen-1-ylphosphinate
SMILESO=P([O-])(c1cccc2ccccc12)c1cccc2ccccc12.[Li+]
InChIInChI=1S/C20H15O2P.Li/c21-23(22,19-13-5-9-15-7-1-3-11-17(15)19)20-14-6-10-16-8-2-4-12-18(16)20;/h1-14H,(H,21,22);/q;+1/p-1
InChIKeyWAXZNMXNNRJCQY-UHFFFAOYSA-M
XLogP0.59
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.25
LogP ≤ 50.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of lithium dinaphthalen-1-ylphosphinate?
The IUPAC name of lithium dinaphthalen-1-ylphosphinate (CID 141248266) is lithium dinaphthalen-1-ylphosphinate.
What is the SMILES notation for lithium dinaphthalen-1-ylphosphinate?
The canonical SMILES for lithium dinaphthalen-1-ylphosphinate is O=P([O-])(c1cccc2ccccc12)c1cccc2ccccc12.[Li+].
What is the InChIKey of lithium dinaphthalen-1-ylphosphinate?
The InChIKey is WAXZNMXNNRJCQY-UHFFFAOYSA-M. The full InChI is InChI=1S/C20H15O2P.Li/c21-23(22,19-13-5-9-15-7-1-3-11-17(15)19)20-14-6-10-16-8-2-4-12-18(16)20;/h1-14H,(H,21,22);/q;+1/p-1.
What are the key properties of lithium dinaphthalen-1-ylphosphinate?
lithium dinaphthalen-1-ylphosphinate has a molecular weight of 324.25 g/mol, XLogP of 0.59, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium dinaphthalen-1-ylphosphinate is sourced from PubChem (CID 141248266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).