strontium;ethane-1,2-diol;diacetate

C6H12O6Sr — CID 159361133

IUPACstrontium;ethane-1,2-diol;diacetate
SMILESCC(=O)[O-].CC(=O)[O-].OCCO.[Sr+2]
InChIInChI=1S/2C2H4O2.C2H6O2.Sr/c2*1-2(3)4;3-1-2-4;/h2*1H3,(H,3,4);3-4H,1-2H2;/q;;;+2/p-2
InChIKeyHNHFAXHHQMXARL-UHFFFAOYSA-L
MW267.78 g/mol
LogP-3.90
Rot. Bonds1

About strontium;ethane-1,2-diol;diacetate

strontium;ethane-1,2-diol;diacetate (PubChem CID 159361133) has the molecular formula C6H12O6Sr and a molecular weight of 267.78 g/mol. Its IUPAC name is strontium;ethane-1,2-diol;diacetate.

Molecular Properties

Compound Namestrontium;ethane-1,2-diol;diacetate
PubChem CID159361133
Molecular FormulaC6H12O6Sr
Molecular Weight267.78 g/mol
Exact Mass267.97
IUPAC Namestrontium;ethane-1,2-diol;diacetate
SMILESCC(=O)[O-].CC(=O)[O-].OCCO.[Sr+2]
InChIInChI=1S/2C2H4O2.C2H6O2.Sr/c2*1-2(3)4;3-1-2-4;/h2*1H3,(H,3,4);3-4H,1-2H2;/q;;;+2/p-2
InChIKeyHNHFAXHHQMXARL-UHFFFAOYSA-L
XLogP-3.90
TPSA120.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.78
LogP ≤ 5-3.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

sodium;acetic acid;ethane-1,2-diol;acetate
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bis(ethane-1,2-diol);bis(propan-2-one)
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strontium;acetate;hexahydrate
CID 19795582
strontium;acetate;fluoride
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silver;ethanol;acetate
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sodium;dodecane-1,12-diol;acetate
CID 162312075
hydroxymethylphosphanium;acetate;phosphate
CID 163479536
europium(2+);propanoate
CID 88778777
phosphanylphosphanium acetate
CID 162334335
CID 87243144
CID 87243144
bis(titanium(2+));tetraacetate
CID 18459511
germanium(4+) tetraacetate
CID 158263361

Frequently Asked Questions

What is the IUPAC name of strontium;ethane-1,2-diol;diacetate?
The IUPAC name of strontium;ethane-1,2-diol;diacetate (CID 159361133) is strontium;ethane-1,2-diol;diacetate.
What is the SMILES notation for strontium;ethane-1,2-diol;diacetate?
The canonical SMILES for strontium;ethane-1,2-diol;diacetate is CC(=O)[O-].CC(=O)[O-].OCCO.[Sr+2].
What is the InChIKey of strontium;ethane-1,2-diol;diacetate?
The InChIKey is HNHFAXHHQMXARL-UHFFFAOYSA-L. The full InChI is InChI=1S/2C2H4O2.C2H6O2.Sr/c2*1-2(3)4;3-1-2-4;/h2*1H3,(H,3,4);3-4H,1-2H2;/q;;;+2/p-2.
What are the key properties of strontium;ethane-1,2-diol;diacetate?
strontium;ethane-1,2-diol;diacetate has a molecular weight of 267.78 g/mol, XLogP of -3.90, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for strontium;ethane-1,2-diol;diacetate is sourced from PubChem (CID 159361133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).