aluminum tris((2R)-2-hydroxypropanoate)

C9H15AlO9 — CID 175713416

IUPACaluminum tris((2R)-2-hydroxypropanoate)
SMILESC[C@@H](O)C(=O)[O-].C[C@@H](O)C(=O)[O-].C[C@@H](O)C(=O)[O-].[Al+3]
InChIInChI=1S/3C3H6O3.Al/c3*1-2(4)3(5)6;/h3*2,4H,1H3,(H,5,6);/q;;;+3/p-3/t3*2-;/m111./s1
InChIKeyVXYADVIJALMOEQ-KTDMQOEBSA-K
MW294.19 g/mol
LogP-6.03
Rot. Bonds3

About aluminum tris((2R)-2-hydroxypropanoate)

aluminum tris((2R)-2-hydroxypropanoate) (PubChem CID 175713416) has the molecular formula C9H15AlO9 and a molecular weight of 294.19 g/mol. Its IUPAC name is aluminum tris((2R)-2-hydroxypropanoate).

Molecular Properties

Compound Namealuminum tris((2R)-2-hydroxypropanoate)
PubChem CID175713416
Molecular FormulaC9H15AlO9
Molecular Weight294.19 g/mol
Exact Mass294.05
IUPAC Namealuminum tris((2R)-2-hydroxypropanoate)
SMILESC[C@@H](O)C(=O)[O-].C[C@@H](O)C(=O)[O-].C[C@@H](O)C(=O)[O-].[Al+3]
InChIInChI=1S/3C3H6O3.Al/c3*1-2(4)3(5)6;/h3*2,4H,1H3,(H,5,6);/q;;;+3/p-3/t3*2-;/m111./s1
InChIKeyVXYADVIJALMOEQ-KTDMQOEBSA-K
XLogP-6.03
TPSA181.08 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.19
LogP ≤ 5-6.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

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Related Compounds

copper bis(2-hydroxypropanoate)
CID 13145
iodanium 2-hydroxypropanoate
CID 158316585
potassium 2-hydroxypropanoate
CID 23671663
silver (2R)-2-hydroxypropanoate
CID 14178856
tris(2-hydroxypropanoate);zirconium(3+)
CID 3048680
bis(2-hydroxypropanoate);nickel(2+)
CID 15920056
2-hydroxypropanoate;tantalum(5+)
CID 172796362
strontium bis(2-hydroxypropanoate)
CID 91886528
gold(3+);tris(2-hydroxypropanoate)
CID 157164422
tris(2-hydroxypropanoate);yttrium(3+)
CID 14619044
aluminum;sodium;2-hydroxypropanoate;zirconium(4+);hydroxide
CID 159641073
aluminum;sodium;2-hydroxypropanoate;trihypochlorite
CID 173216402

Frequently Asked Questions

What is the IUPAC name of aluminum tris((2R)-2-hydroxypropanoate)?
The IUPAC name of aluminum tris((2R)-2-hydroxypropanoate) (CID 175713416) is aluminum tris((2R)-2-hydroxypropanoate).
What is the SMILES notation for aluminum tris((2R)-2-hydroxypropanoate)?
The canonical SMILES for aluminum tris((2R)-2-hydroxypropanoate) is C[C@@H](O)C(=O)[O-].C[C@@H](O)C(=O)[O-].C[C@@H](O)C(=O)[O-].[Al+3].
What is the InChIKey of aluminum tris((2R)-2-hydroxypropanoate)?
The InChIKey is VXYADVIJALMOEQ-KTDMQOEBSA-K. The full InChI is InChI=1S/3C3H6O3.Al/c3*1-2(4)3(5)6;/h3*2,4H,1H3,(H,5,6);/q;;;+3/p-3/t3*2-;/m111./s1.
What are the key properties of aluminum tris((2R)-2-hydroxypropanoate)?
aluminum tris((2R)-2-hydroxypropanoate) has a molecular weight of 294.19 g/mol, XLogP of -6.03, 3 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum tris((2R)-2-hydroxypropanoate) is sourced from PubChem (CID 175713416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).