lithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide

C18H13Li — CID 161283415

IUPAClithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide
SMILES[Li+].[c-]1c(C2C=CC=C2)ccc2c1Cc1ccccc1-2
InChIInChI=1S/C18H13.Li/c1-2-6-13(5-1)14-9-10-18-16(11-14)12-15-7-3-4-8-17(15)18;/h1-10,13H,12H2;/q-1;+1
InChIKeyLMCCCGVESRGCKP-UHFFFAOYSA-N
MW236.24 g/mol
LogP1.27
Rot. Bonds1

About lithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide

lithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide (PubChem CID 161283415) has the molecular formula C18H13Li and a molecular weight of 236.24 g/mol. Its IUPAC name is lithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide.

Molecular Properties

Compound Namelithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide
PubChem CID161283415
Molecular FormulaC18H13Li
Molecular Weight236.24 g/mol
Exact Mass236.12
IUPAC Namelithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide
SMILES[Li+].[c-]1c(C2C=CC=C2)ccc2c1Cc1ccccc1-2
InChIInChI=1S/C18H13.Li/c1-2-6-13(5-1)14-9-10-18-16(11-14)12-15-7-3-4-8-17(15)18;/h1-10,13H,12H2;/q-1;+1
InChIKeyLMCCCGVESRGCKP-UHFFFAOYSA-N
XLogP1.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.24
LogP ≤ 51.27
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

CID 161189718
CID 161189718
methanol;2-methyl-1,9-dihydrofluoren-1-ide;titanium
CID 174331013
tetrakis(2-methyl-1,9-dihydrofluoren-1-ide);bis(zirconium(2+));dichloride
CID 18469369
bis(2-methyl-1,9-dihydrofluoren-1-ide);titanium(4+);dichloride
CID 87200949
2-methyl-1,9-dihydrofluoren-1-ide;trichlorotitanium(1+)
CID 87704393
dichlorozirconium(2+);bis(2-methyl-1,9-dihydrofluoren-1-ide)
CID 87824196
1,9-dihydrofluoren-1-ide;titanium(4+);trifluoride
CID 173097726
bis(1,9-dihydrofluoren-1-ide);zirconium(3+);trichloride
CID 157229521
1,9-dihydrofluoren-1-ide;vanadium(4+);trichloride
CID 173274804
bis(1,9-dihydrofluoren-1-ide);methane;zirconium(2+)
CID 22027323
1,9-dihydrofluoren-1-ide;zirconium(4+);tribromide
CID 173097773
carbanide;2-cyclopenta-1,3-dien-1-yl-1,9-dihydrofluoren-1-ide;silylidenezirconium;dihydrochloride
CID 173014129

Frequently Asked Questions

What is the IUPAC name of lithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide?
The IUPAC name of lithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide (CID 161283415) is lithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide.
What is the SMILES notation for lithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide?
The canonical SMILES for lithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide is [Li+].[c-]1c(C2C=CC=C2)ccc2c1Cc1ccccc1-2.
What is the InChIKey of lithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide?
The InChIKey is LMCCCGVESRGCKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13.Li/c1-2-6-13(5-1)14-9-10-18-16(11-14)12-15-7-3-4-8-17(15)18;/h1-10,13H,12H2;/q-1;+1.
What are the key properties of lithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide?
lithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide has a molecular weight of 236.24 g/mol, XLogP of 1.27, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 2-cyclopenta-2,4-dien-1-yl-1,9-dihydrofluoren-1-ide is sourced from PubChem (CID 161283415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).