tetrakis(2-ethylhexanoic acid);hafnium

C32H64HfO8 — CID 140535448

IUPACtetrakis(2-ethylhexanoic acid);hafnium
SMILESCCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.[Hf]
InChIInChI=1S/4C8H16O2.Hf/c4*1-3-5-6-7(4-2)8(9)10;/h4*7H,3-6H2,1-2H3,(H,9,10);
InChIKeyLRDWACSDJCTUHT-UHFFFAOYSA-N
MW755.35 g/mol
LogP9.15
Rot. Bonds20

About tetrakis(2-ethylhexanoic acid);hafnium

tetrakis(2-ethylhexanoic acid);hafnium (PubChem CID 140535448) has the molecular formula C32H64HfO8 and a molecular weight of 755.35 g/mol. Its IUPAC name is tetrakis(2-ethylhexanoic acid);hafnium.

Molecular Properties

Compound Nametetrakis(2-ethylhexanoic acid);hafnium
PubChem CID140535448
Molecular FormulaC32H64HfO8
Molecular Weight755.35 g/mol
Exact Mass756.41
IUPAC Nametetrakis(2-ethylhexanoic acid);hafnium
SMILESCCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.[Hf]
InChIInChI=1S/4C8H16O2.Hf/c4*1-3-5-6-7(4-2)8(9)10;/h4*7H,3-6H2,1-2H3,(H,9,10);
InChIKeyLRDWACSDJCTUHT-UHFFFAOYSA-N
XLogP9.15
TPSA149.20 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds20
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500755.35
LogP ≤ 59.15
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethylhexanoic acid;palladium(2+)
CID 18629949
cobalt;bis(2-ethylhexanoic acid)
CID 85390748
2-ethylhexanoic acid;niobium
CID 87060397
copper 2-ethylhexanoic acid
CID 54604905
bis(2-ethylhexanoic acid);manganese
CID 173402583
bis(2-ethylhexanoic acid);manganese(3+)
CID 175736722
barium(2+);2-ethylhexanoic acid;hydride
CID 172997422
2-ethylhexanoic acid;hexadecane
CID 174408772
cobalt;bis(2-ethylhexanoic acid);nickel
CID 173442875
tris(2-ethylhexanoic acid);propan-2-yl-λ2-stannane
CID 173133127
cyclohexane;2-ethylhexanoic acid;nickel
CID 174366727
boric acid;2-ethylhexanoic acid;niobium
CID 163361263

Frequently Asked Questions

What is the IUPAC name of tetrakis(2-ethylhexanoic acid);hafnium?
The IUPAC name of tetrakis(2-ethylhexanoic acid);hafnium (CID 140535448) is tetrakis(2-ethylhexanoic acid);hafnium.
What is the SMILES notation for tetrakis(2-ethylhexanoic acid);hafnium?
The canonical SMILES for tetrakis(2-ethylhexanoic acid);hafnium is CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.[Hf].
What is the InChIKey of tetrakis(2-ethylhexanoic acid);hafnium?
The InChIKey is LRDWACSDJCTUHT-UHFFFAOYSA-N. The full InChI is InChI=1S/4C8H16O2.Hf/c4*1-3-5-6-7(4-2)8(9)10;/h4*7H,3-6H2,1-2H3,(H,9,10);.
What are the key properties of tetrakis(2-ethylhexanoic acid);hafnium?
tetrakis(2-ethylhexanoic acid);hafnium has a molecular weight of 755.35 g/mol, XLogP of 9.15, 20 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(2-ethylhexanoic acid);hafnium is sourced from PubChem (CID 140535448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).