bis(2-hydroxyethoxy)stibanyl acetate

C6H13O6Sb — CID 16684127

IUPACbis(2-hydroxyethoxy)stibanyl acetate
SMILESCC(=O)O[Sb](OCCO)OCCO
InChIInChI=1S/C2H4O2.2C2H5O2.Sb/c1-2(3)4;2*3-1-2-4;/h1H3,(H,3,4);2*3H,1-2H2;/q;2*-1;+3/p-1
InChIKeyNHAFKGCSNRKGAY-UHFFFAOYSA-M
MW302.92 g/mol
LogP-1.45
Rot. Bonds7

About bis(2-hydroxyethoxy)stibanyl acetate

bis(2-hydroxyethoxy)stibanyl acetate (PubChem CID 16684127) has the molecular formula C6H13O6Sb and a molecular weight of 302.92 g/mol. Its IUPAC name is bis(2-hydroxyethoxy)stibanyl acetate.

Molecular Properties

Compound Namebis(2-hydroxyethoxy)stibanyl acetate
PubChem CID16684127
Molecular FormulaC6H13O6Sb
Molecular Weight302.92 g/mol
Exact Mass301.98
IUPAC Namebis(2-hydroxyethoxy)stibanyl acetate
SMILESCC(=O)O[Sb](OCCO)OCCO
InChIInChI=1S/C2H4O2.2C2H5O2.Sb/c1-2(3)4;2*3-1-2-4;/h1H3,(H,3,4);2*3H,1-2H2;/q;2*-1;+3/p-1
InChIKeyNHAFKGCSNRKGAY-UHFFFAOYSA-M
XLogP-1.45
TPSA85.22 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.92
LogP ≤ 5-1.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

diacetyloxystibanyl acetate
CID 16685080
acetic acid;diacetyloxystibanyl acetate;zinc
CID 175934647
chloro acetate;2-(2-hydroxyethoxy)ethanol
CID 170842530
ethane-1,2-diol;2-hydroxyethyl ethaneperoxoate
CID 174290784
acetic acid;2-(2-hydroxyethoxy)ethanol
CID 158067636
2-hydroxyethyl acetate;2-methoxyethyl acetate
CID 159506787
2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl acetate
CID 91699049
acetic acid;acetyl ethaneperoxoate;2-(2-hydroxyethoxy)ethanol
CID 88742997
(dioxo-λ5-stibanyl) acetate
CID 139631794
acetic acid;2-(hydroxymethoxy)ethanol
CID 53447013
bis(1-hydroxypropan-2-one);2-methoxyethanol
CID 88639054
bromo acetate;ethane-1,2-diol
CID 88743999

Frequently Asked Questions

What is the IUPAC name of bis(2-hydroxyethoxy)stibanyl acetate?
The IUPAC name of bis(2-hydroxyethoxy)stibanyl acetate (CID 16684127) is bis(2-hydroxyethoxy)stibanyl acetate.
What is the SMILES notation for bis(2-hydroxyethoxy)stibanyl acetate?
The canonical SMILES for bis(2-hydroxyethoxy)stibanyl acetate is CC(=O)O[Sb](OCCO)OCCO.
What is the InChIKey of bis(2-hydroxyethoxy)stibanyl acetate?
The InChIKey is NHAFKGCSNRKGAY-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H4O2.2C2H5O2.Sb/c1-2(3)4;2*3-1-2-4;/h1H3,(H,3,4);2*3H,1-2H2;/q;2*-1;+3/p-1.
What are the key properties of bis(2-hydroxyethoxy)stibanyl acetate?
bis(2-hydroxyethoxy)stibanyl acetate has a molecular weight of 302.92 g/mol, XLogP of -1.45, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-hydroxyethoxy)stibanyl acetate is sourced from PubChem (CID 16684127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).