sodium 9-phenylfluoren-9-ide

C19H13Na — CID 12807151

IUPACsodium 9-phenylfluoren-9-ide
SMILES[Na+].c1ccc(-[c-]2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C19H13.Na/c1-2-8-14(9-3-1)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19;/h1-13H;/q-1;+1
InChIKeyXQDVFVMKYIHTIS-UHFFFAOYSA-N
MW264.30 g/mol
LogP2.38
Rot. Bonds1

About sodium 9-phenylfluoren-9-ide

sodium 9-phenylfluoren-9-ide (PubChem CID 12807151) has the molecular formula C19H13Na and a molecular weight of 264.30 g/mol. Its IUPAC name is sodium 9-phenylfluoren-9-ide.

Molecular Properties

Compound Namesodium 9-phenylfluoren-9-ide
PubChem CID12807151
Molecular FormulaC19H13Na
Molecular Weight264.30 g/mol
Exact Mass264.09
IUPAC Namesodium 9-phenylfluoren-9-ide
SMILES[Na+].c1ccc(-[c-]2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C19H13.Na/c1-2-8-14(9-3-1)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19;/h1-13H;/q-1;+1
InChIKeyXQDVFVMKYIHTIS-UHFFFAOYSA-N
XLogP2.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.30
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

lithium 9-phenylfluoren-9-ide
CID 12807150
lithium 9-benzylfluoren-9-ide
CID 15151325
cesium fluoren-9-id-9-yl(trimethyl)silane
CID 10022036
CID 173299519
CID 173299519
1-phenylinden-1-ide;zirconium;dihydrochloride
CID 174700914
1-phenylinden-1-ide;zirconium;dihydroiodide
CID 174711483
CID 173299729
CID 173299729
1-ethyl-3-phenylinden-1-ide;zirconium;dihydrochloride
CID 174996133
sodium;sulfanide;toluene
CID 174811836
palladium;phosphane;tetrakis(triphenylene)
CID 175547767
sodium;1-ethylnaphthalene;hydride
CID 174300793
sodium;1-ethylnaphthalene;phenoxide
CID 159168482

Frequently Asked Questions

What is the IUPAC name of sodium 9-phenylfluoren-9-ide?
The IUPAC name of sodium 9-phenylfluoren-9-ide (CID 12807151) is sodium 9-phenylfluoren-9-ide.
What is the SMILES notation for sodium 9-phenylfluoren-9-ide?
The canonical SMILES for sodium 9-phenylfluoren-9-ide is [Na+].c1ccc(-[c-]2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of sodium 9-phenylfluoren-9-ide?
The InChIKey is XQDVFVMKYIHTIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13.Na/c1-2-8-14(9-3-1)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19;/h1-13H;/q-1;+1.
What are the key properties of sodium 9-phenylfluoren-9-ide?
sodium 9-phenylfluoren-9-ide has a molecular weight of 264.30 g/mol, XLogP of 2.38, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for sodium 9-phenylfluoren-9-ide is sourced from PubChem (CID 12807151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).