(tetraphenyl-λ5-stibanyl) acetate

C26H23O2Sb — CID 16699436

IUPAC(tetraphenyl-λ5-stibanyl) acetate
SMILESCC(=O)O[Sb](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/4C6H5.C2H4O2.Sb/c4*1-2-4-6-5-3-1;1-2(3)4;/h4*1-5H;1H3,(H,3,4);/q;;;;;+1/p-1
InChIKeyMOQVJYRFLPHSMW-UHFFFAOYSA-M
MW489.23 g/mol
LogP3.08
Rot. Bonds5

About (tetraphenyl-λ5-stibanyl) acetate

(tetraphenyl-λ5-stibanyl) acetate (PubChem CID 16699436) has the molecular formula C26H23O2Sb and a molecular weight of 489.23 g/mol. Its IUPAC name is (tetraphenyl-λ5-stibanyl) acetate.

Molecular Properties

Compound Name(tetraphenyl-λ5-stibanyl) acetate
PubChem CID16699436
Molecular FormulaC26H23O2Sb
Molecular Weight489.23 g/mol
Exact Mass488.07
IUPAC Name(tetraphenyl-λ5-stibanyl) acetate
SMILESCC(=O)O[Sb](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/4C6H5.C2H4O2.Sb/c4*1-2-4-6-5-3-1;1-2(3)4;/h4*1-5H;1H3,(H,3,4);/q;;;;;+1/p-1
InChIKeyMOQVJYRFLPHSMW-UHFFFAOYSA-M
XLogP3.08
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500489.23
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

bis(tetraphenyl-λ5-stibanyl) benzene-1,2-dicarboxylate
CID 16716661
bis(tetraphenyl-λ5-stibanyl) propanedioate
CID 16714240
benzene;ethane;methyl acetate;phenol
CID 162170522
diphenyl carbonate;phenyl acetate
CID 90936233
CID 53446480
CID 53446480
biphenylene;propan-2-one
CID 174440223
benzene;methyl acetate;hydroiodide
CID 174288307
methyl acetate;phenylmethanol
CID 174674344
[(1R)-1-phenylethyl] acetate;[(1S)-1-phenylethyl] acetate
CID 76968517
phenol;propan-2-one;hydrate
CID 161159865
iodobenzene;propan-2-one
CID 159413459
anisole;ethane;propan-2-one
CID 164986667

Frequently Asked Questions

What is the IUPAC name of (tetraphenyl-λ5-stibanyl) acetate?
The IUPAC name of (tetraphenyl-λ5-stibanyl) acetate (CID 16699436) is (tetraphenyl-λ5-stibanyl) acetate.
What is the SMILES notation for (tetraphenyl-λ5-stibanyl) acetate?
The canonical SMILES for (tetraphenyl-λ5-stibanyl) acetate is CC(=O)O[Sb](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (tetraphenyl-λ5-stibanyl) acetate?
The InChIKey is MOQVJYRFLPHSMW-UHFFFAOYSA-M. The full InChI is InChI=1S/4C6H5.C2H4O2.Sb/c4*1-2-4-6-5-3-1;1-2(3)4;/h4*1-5H;1H3,(H,3,4);/q;;;;;+1/p-1.
What are the key properties of (tetraphenyl-λ5-stibanyl) acetate?
(tetraphenyl-λ5-stibanyl) acetate has a molecular weight of 489.23 g/mol, XLogP of 3.08, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (tetraphenyl-λ5-stibanyl) acetate is sourced from PubChem (CID 16699436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).