Antimony(3+);tris(2-sulfanylpropanoate)

C9H15O6S3Sb — CID 23452047

IUPACantimony(3+);tris(2-sulfanylpropanoate)
SMILESCC(C(=O)[O-])S.CC(C(=O)[O-])S.CC(C(=O)[O-])S.[Sb+3]
InChIInChI=1S/3C3H6O2S.Sb/c3*1-2(6)3(4)5;/h3*2,6H,1H3,(H,4,5);/q;;;+3/p-3
InChIKeyGHFOMEVVHPNYBB-UHFFFAOYSA-K
MW437.20 g/mol
LogP—
Rot. Bonds

About Antimony(3+);tris(2-sulfanylpropanoate)

Antimony(3+);tris(2-sulfanylpropanoate) (PubChem CID 23452047) has the molecular formula C9H15O6S3Sb and a molecular weight of 437.20 g/mol. Its IUPAC name is antimony(3+);tris(2-sulfanylpropanoate).

Molecular Properties

Compound NameAntimony(3+);tris(2-sulfanylpropanoate)
PubChem CID23452047
Molecular FormulaC9H15O6S3Sb
Molecular Weight437.20 g/mol
Exact Mass435.91
IUPAC Nameantimony(3+);tris(2-sulfanylpropanoate)
SMILESCC(C(=O)[O-])S.CC(C(=O)[O-])S.CC(C(=O)[O-])S.[Sb+3]
InChIInChI=1S/3C3H6O2S.Sb/c3*1-2(6)3(4)5;/h3*2,6H,1H3,(H,4,5);/q;;;+3/p-3
InChIKeyGHFOMEVVHPNYBB-UHFFFAOYSA-K
XLogP—
TPSA123.00 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms19
Complexity56

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of Antimony(3+);tris(2-sulfanylpropanoate)?
The IUPAC name of Antimony(3+);tris(2-sulfanylpropanoate) (CID 23452047) is antimony(3+);tris(2-sulfanylpropanoate).
What is the SMILES notation for Antimony(3+);tris(2-sulfanylpropanoate)?
The canonical SMILES for Antimony(3+);tris(2-sulfanylpropanoate) is CC(C(=O)[O-])S.CC(C(=O)[O-])S.CC(C(=O)[O-])S.[Sb+3].
What is the InChIKey of Antimony(3+);tris(2-sulfanylpropanoate)?
The InChIKey is GHFOMEVVHPNYBB-UHFFFAOYSA-K. The full InChI is InChI=1S/3C3H6O2S.Sb/c3*1-2(6)3(4)5;/h3*2,6H,1H3,(H,4,5);/q;;;+3/p-3.
What are the key properties of Antimony(3+);tris(2-sulfanylpropanoate)?
Antimony(3+);tris(2-sulfanylpropanoate) has a molecular weight of 437.20 g/mol, XLogP of not available, 0 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for Antimony(3+);tris(2-sulfanylpropanoate) is sourced from PubChem (CID 23452047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).