hafnium(4+);bis(propan-2-olate)

C6H14HfO2+2 — CID 22242333

IUPAChafnium(4+);bis(propan-2-olate)
SMILESCC(C)[O-].CC(C)[O-].[Hf+4]
InChIInChI=1S/2C3H7O.Hf/c2*1-3(2)4;/h2*3H,1-2H3;/q2*-1;+4
InChIKeyCQQZTBOSLCKNPK-UHFFFAOYSA-N
MW296.67 g/mol
LogP-0.49
Rot. Bonds

About hafnium(4+);bis(propan-2-olate)

hafnium(4+);bis(propan-2-olate) (PubChem CID 22242333) has the molecular formula C6H14HfO2+2 and a molecular weight of 296.67 g/mol. Its IUPAC name is hafnium(4+);bis(propan-2-olate).

Molecular Properties

Compound Namehafnium(4+);bis(propan-2-olate)
PubChem CID22242333
Molecular FormulaC6H14HfO2+2
Molecular Weight296.67 g/mol
Exact Mass298.04
IUPAC Namehafnium(4+);bis(propan-2-olate)
SMILESCC(C)[O-].CC(C)[O-].[Hf+4]
InChIInChI=1S/2C3H7O.Hf/c2*1-3(2)4;/h2*3H,1-2H3;/q2*-1;+4
InChIKeyCQQZTBOSLCKNPK-UHFFFAOYSA-N
XLogP-0.49
TPSA46.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.67
LogP ≤ 5-0.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of hafnium(4+);bis(propan-2-olate)?
The IUPAC name of hafnium(4+);bis(propan-2-olate) (CID 22242333) is hafnium(4+);bis(propan-2-olate).
What is the SMILES notation for hafnium(4+);bis(propan-2-olate)?
The canonical SMILES for hafnium(4+);bis(propan-2-olate) is CC(C)[O-].CC(C)[O-].[Hf+4].
What is the InChIKey of hafnium(4+);bis(propan-2-olate)?
The InChIKey is CQQZTBOSLCKNPK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H7O.Hf/c2*1-3(2)4;/h2*3H,1-2H3;/q2*-1;+4.
What are the key properties of hafnium(4+);bis(propan-2-olate)?
hafnium(4+);bis(propan-2-olate) has a molecular weight of 296.67 g/mol, XLogP of -0.49, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hafnium(4+);bis(propan-2-olate) is sourced from PubChem (CID 22242333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).