4-fluorophenol;zirconium

C6H5FOZr — CID 74015831

IUPAC4-fluorophenol;zirconium
SMILESOc1ccc(F)cc1.[Zr]
InChIInChI=1S/C6H5FO.Zr/c7-5-1-3-6(8)4-2-5;/h1-4,8H;
InChIKeyGBXGJZJZBMLLHD-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.53
Rot. Bonds

About 4-fluorophenol;zirconium

4-fluorophenol;zirconium (PubChem CID 74015831) has the molecular formula C6H5FOZr and a molecular weight of 203.33 g/mol. Its IUPAC name is 4-fluorophenol;zirconium.

Molecular Properties

Compound Name4-fluorophenol;zirconium
PubChem CID74015831
Molecular FormulaC6H5FOZr
Molecular Weight203.33 g/mol
Exact Mass201.94
IUPAC Name4-fluorophenol;zirconium
SMILESOc1ccc(F)cc1.[Zr]
InChIInChI=1S/C6H5FO.Zr/c7-5-1-3-6(8)4-2-5;/h1-4,8H;
InChIKeyGBXGJZJZBMLLHD-UHFFFAOYSA-N
XLogP1.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-fluorophenol;zirconium?
The IUPAC name of 4-fluorophenol;zirconium (CID 74015831) is 4-fluorophenol;zirconium.
What is the SMILES notation for 4-fluorophenol;zirconium?
The canonical SMILES for 4-fluorophenol;zirconium is Oc1ccc(F)cc1.[Zr].
What is the InChIKey of 4-fluorophenol;zirconium?
The InChIKey is GBXGJZJZBMLLHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5FO.Zr/c7-5-1-3-6(8)4-2-5;/h1-4,8H;.
What are the key properties of 4-fluorophenol;zirconium?
4-fluorophenol;zirconium has a molecular weight of 203.33 g/mol, XLogP of 1.53, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluorophenol;zirconium is sourced from PubChem (CID 74015831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).