2,3,4,5-tetramethyl-1-phenylstibole

C14H17Sb — CID 14026310

IUPAC2,3,4,5-tetramethyl-1-phenylstibole
SMILESCC1=C(C)[Sb](c2ccccc2)C(C)=C1C
InChIInChI=1S/C8H12.C6H5.Sb/c1-5-7(3)8(4)6-2;1-2-4-6-5-3-1;/h1-4H3;1-5H;
InChIKeyCXOCBUVGPSARBR-UHFFFAOYSA-N
MW307.05 g/mol
LogP3.15
Rot. Bonds1

About 2,3,4,5-tetramethyl-1-phenylstibole

2,3,4,5-tetramethyl-1-phenylstibole (PubChem CID 14026310) has the molecular formula C14H17Sb and a molecular weight of 307.05 g/mol. Its IUPAC name is 2,3,4,5-tetramethyl-1-phenylstibole.

Molecular Properties

Compound Name2,3,4,5-tetramethyl-1-phenylstibole
PubChem CID14026310
Molecular FormulaC14H17Sb
Molecular Weight307.05 g/mol
Exact Mass306.04
IUPAC Name2,3,4,5-tetramethyl-1-phenylstibole
SMILESCC1=C(C)[Sb](c2ccccc2)C(C)=C1C
InChIInChI=1S/C8H12.C6H5.Sb/c1-5-7(3)8(4)6-2;1-2-4-6-5-3-1;/h1-4H3;1-5H;
InChIKeyCXOCBUVGPSARBR-UHFFFAOYSA-N
XLogP3.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.05
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 2,3,4,5-tetramethyl-1-phenylstibole 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 2,3,4,5-tetramethyl-1-phenylstibole?
The IUPAC name of 2,3,4,5-tetramethyl-1-phenylstibole (CID 14026310) is 2,3,4,5-tetramethyl-1-phenylstibole.
What is the SMILES notation for 2,3,4,5-tetramethyl-1-phenylstibole?
The canonical SMILES for 2,3,4,5-tetramethyl-1-phenylstibole is CC1=C(C)[Sb](c2ccccc2)C(C)=C1C.
What is the InChIKey of 2,3,4,5-tetramethyl-1-phenylstibole?
The InChIKey is CXOCBUVGPSARBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12.C6H5.Sb/c1-5-7(3)8(4)6-2;1-2-4-6-5-3-1;/h1-4H3;1-5H;.
What are the key properties of 2,3,4,5-tetramethyl-1-phenylstibole?
2,3,4,5-tetramethyl-1-phenylstibole has a molecular weight of 307.05 g/mol, XLogP of 3.15, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetramethyl-1-phenylstibole is sourced from PubChem (CID 14026310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).