lithium 9H-fluoren-9-olate

C13H9LiO — CID 20660812

IUPAClithium 9H-fluoren-9-olate
SMILES[Li+].[O-]C1c2ccccc2-c2ccccc21
InChIInChI=1S/C13H9O.Li/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13;/h1-8,13H;/q-1;+1
InChIKeyCPWPAHGWYFOFNF-UHFFFAOYSA-N
MW188.16 g/mol
LogP-0.88
Rot. Bonds

About lithium 9H-fluoren-9-olate

lithium 9H-fluoren-9-olate (PubChem CID 20660812) has the molecular formula C13H9LiO and a molecular weight of 188.16 g/mol. Its IUPAC name is lithium 9H-fluoren-9-olate.

Molecular Properties

Compound Namelithium 9H-fluoren-9-olate
PubChem CID20660812
Molecular FormulaC13H9LiO
Molecular Weight188.16 g/mol
Exact Mass188.08
IUPAC Namelithium 9H-fluoren-9-olate
SMILES[Li+].[O-]C1c2ccccc2-c2ccccc21
InChIInChI=1S/C13H9O.Li/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13;/h1-8,13H;/q-1;+1
InChIKeyCPWPAHGWYFOFNF-UHFFFAOYSA-N
XLogP-0.88
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.16
LogP ≤ 5-0.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of lithium 9H-fluoren-9-olate?
The IUPAC name of lithium 9H-fluoren-9-olate (CID 20660812) is lithium 9H-fluoren-9-olate.
What is the SMILES notation for lithium 9H-fluoren-9-olate?
The canonical SMILES for lithium 9H-fluoren-9-olate is [Li+].[O-]C1c2ccccc2-c2ccccc21.
What is the InChIKey of lithium 9H-fluoren-9-olate?
The InChIKey is CPWPAHGWYFOFNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9O.Li/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13;/h1-8,13H;/q-1;+1.
What are the key properties of lithium 9H-fluoren-9-olate?
lithium 9H-fluoren-9-olate has a molecular weight of 188.16 g/mol, XLogP of -0.88, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 9H-fluoren-9-olate is sourced from PubChem (CID 20660812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).