carboxyoxy(phenyl)stibinic acid

C7H7O5Sb — CID 88749053

IUPACcarboxyoxy(phenyl)stibinic acid
SMILESO=C(O)O[Sb](=O)(O)c1ccccc1
InChIInChI=1S/C6H5.CH2O3.H2O.O.Sb/c1-2-4-6-5-3-1;2-1(3)4;;;/h1-5H;(H2,2,3,4);1H2;;/q;;;;+2/p-2
InChIKeyFSHHEEBEOYFKJU-UHFFFAOYSA-L
MW292.89 g/mol
LogP-0.05
Rot. Bonds2

About carboxyoxy(phenyl)stibinic acid

carboxyoxy(phenyl)stibinic acid (PubChem CID 88749053) has the molecular formula C7H7O5Sb and a molecular weight of 292.89 g/mol. Its IUPAC name is carboxyoxy(phenyl)stibinic acid.

Molecular Properties

Compound Namecarboxyoxy(phenyl)stibinic acid
PubChem CID88749053
Molecular FormulaC7H7O5Sb
Molecular Weight292.89 g/mol
Exact Mass291.93
IUPAC Namecarboxyoxy(phenyl)stibinic acid
SMILESO=C(O)O[Sb](=O)(O)c1ccccc1
InChIInChI=1S/C6H5.CH2O3.H2O.O.Sb/c1-2-4-6-5-3-1;2-1(3)4;;;/h1-5H;(H2,2,3,4);1H2;;/q;;;;+2/p-2
InChIKeyFSHHEEBEOYFKJU-UHFFFAOYSA-L
XLogP-0.05
TPSA83.83 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.89
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze carboxyoxy(phenyl)stibinic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of carboxyoxy(phenyl)stibinic acid?
The IUPAC name of carboxyoxy(phenyl)stibinic acid (CID 88749053) is carboxyoxy(phenyl)stibinic acid.
What is the SMILES notation for carboxyoxy(phenyl)stibinic acid?
The canonical SMILES for carboxyoxy(phenyl)stibinic acid is O=C(O)O[Sb](=O)(O)c1ccccc1.
What is the InChIKey of carboxyoxy(phenyl)stibinic acid?
The InChIKey is FSHHEEBEOYFKJU-UHFFFAOYSA-L. The full InChI is InChI=1S/C6H5.CH2O3.H2O.O.Sb/c1-2-4-6-5-3-1;2-1(3)4;;;/h1-5H;(H2,2,3,4);1H2;;/q;;;;+2/p-2.
What are the key properties of carboxyoxy(phenyl)stibinic acid?
carboxyoxy(phenyl)stibinic acid has a molecular weight of 292.89 g/mol, XLogP of -0.05, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for carboxyoxy(phenyl)stibinic acid is sourced from PubChem (CID 88749053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).