hafnium diphenoxide

C12H10HfO2-2 — CID 175882420

IUPAChafnium diphenoxide
SMILES[Hf].[O-]c1ccccc1.[O-]c1ccccc1
InChIInChI=1S/2C6H6O.Hf/c2*7-6-4-2-1-3-5-6;/h2*1-5,7H;/p-2
InChIKeyHUMDQWALPCXTND-UHFFFAOYSA-L
MW364.70 g/mol
LogP1.52
Rot. Bonds

About hafnium diphenoxide

hafnium diphenoxide (PubChem CID 175882420) has the molecular formula C12H10HfO2-2 and a molecular weight of 364.70 g/mol. Its IUPAC name is hafnium diphenoxide.

Molecular Properties

Compound Namehafnium diphenoxide
PubChem CID175882420
Molecular FormulaC12H10HfO2-2
Molecular Weight364.70 g/mol
Exact Mass366.02
IUPAC Namehafnium diphenoxide
SMILES[Hf].[O-]c1ccccc1.[O-]c1ccccc1
InChIInChI=1S/2C6H6O.Hf/c2*7-6-4-2-1-3-5-6;/h2*1-5,7H;/p-2
InChIKeyHUMDQWALPCXTND-UHFFFAOYSA-L
XLogP1.52
TPSA46.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.70
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of hafnium diphenoxide?
The IUPAC name of hafnium diphenoxide (CID 175882420) is hafnium diphenoxide.
What is the SMILES notation for hafnium diphenoxide?
The canonical SMILES for hafnium diphenoxide is [Hf].[O-]c1ccccc1.[O-]c1ccccc1.
What is the InChIKey of hafnium diphenoxide?
The InChIKey is HUMDQWALPCXTND-UHFFFAOYSA-L. The full InChI is InChI=1S/2C6H6O.Hf/c2*7-6-4-2-1-3-5-6;/h2*1-5,7H;/p-2.
What are the key properties of hafnium diphenoxide?
hafnium diphenoxide has a molecular weight of 364.70 g/mol, XLogP of 1.52, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hafnium diphenoxide is sourced from PubChem (CID 175882420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).