2-(1H-inden-2-yl)furan;zirconium

C13H10OZr — CID 174544021

IUPAC2-(1H-inden-2-yl)furan;zirconium
SMILESC1=C(c2ccco2)Cc2ccccc21.[Zr]
InChIInChI=1S/C13H10O.Zr/c1-2-5-11-9-12(8-10(11)4-1)13-6-3-7-14-13;/h1-8H,9H2;
InChIKeyGEITYFLCGTWOQD-UHFFFAOYSA-N
MW273.45 g/mol
LogP3.37
Rot. Bonds1

About 2-(1H-inden-2-yl)furan;zirconium

2-(1H-inden-2-yl)furan;zirconium (PubChem CID 174544021) has the molecular formula C13H10OZr and a molecular weight of 273.45 g/mol. Its IUPAC name is 2-(1H-inden-2-yl)furan;zirconium.

Molecular Properties

Compound Name2-(1H-inden-2-yl)furan;zirconium
PubChem CID174544021
Molecular FormulaC13H10OZr
Molecular Weight273.45 g/mol
Exact Mass271.98
IUPAC Name2-(1H-inden-2-yl)furan;zirconium
SMILESC1=C(c2ccco2)Cc2ccccc21.[Zr]
InChIInChI=1S/C13H10O.Zr/c1-2-5-11-9-12(8-10(11)4-1)13-6-3-7-14-13;/h1-8H,9H2;
InChIKeyGEITYFLCGTWOQD-UHFFFAOYSA-N
XLogP3.37
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.45
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-inden-2-yl)furan;zirconium?
The IUPAC name of 2-(1H-inden-2-yl)furan;zirconium (CID 174544021) is 2-(1H-inden-2-yl)furan;zirconium.
What is the SMILES notation for 2-(1H-inden-2-yl)furan;zirconium?
The canonical SMILES for 2-(1H-inden-2-yl)furan;zirconium is C1=C(c2ccco2)Cc2ccccc21.[Zr].
What is the InChIKey of 2-(1H-inden-2-yl)furan;zirconium?
The InChIKey is GEITYFLCGTWOQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10O.Zr/c1-2-5-11-9-12(8-10(11)4-1)13-6-3-7-14-13;/h1-8H,9H2;.
What are the key properties of 2-(1H-inden-2-yl)furan;zirconium?
2-(1H-inden-2-yl)furan;zirconium has a molecular weight of 273.45 g/mol, XLogP of 3.37, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-inden-2-yl)furan;zirconium is sourced from PubChem (CID 174544021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).