antimony(3+);tris(6-methylquinolin-8-olate)

C30H24N3O3Sb — CID 3043305

IUPACantimony(3+);tris(6-methylquinolin-8-olate)
SMILESCc1cc([O-])c2ncccc2c1.Cc1cc([O-])c2ncccc2c1.Cc1cc([O-])c2ncccc2c1.[Sb+3]
InChIInChI=1S/3C10H9NO.Sb/c3*1-7-5-8-3-2-4-11-10(8)9(12)6-7;/h3*2-6,12H,1H3;/q;;;+3/p-3
InChIKeyTYMLYKUHOCWESL-UHFFFAOYSA-K
MW596.30 g/mol
LogP4.47
Rot. Bonds

About antimony(3+);tris(6-methylquinolin-8-olate)

antimony(3+);tris(6-methylquinolin-8-olate) (PubChem CID 3043305) has the molecular formula C30H24N3O3Sb and a molecular weight of 596.30 g/mol. Its IUPAC name is antimony(3+);tris(6-methylquinolin-8-olate).

Molecular Properties

Compound Nameantimony(3+);tris(6-methylquinolin-8-olate)
PubChem CID3043305
Molecular FormulaC30H24N3O3Sb
Molecular Weight596.30 g/mol
Exact Mass595.09
IUPAC Nameantimony(3+);tris(6-methylquinolin-8-olate)
SMILESCc1cc([O-])c2ncccc2c1.Cc1cc([O-])c2ncccc2c1.Cc1cc([O-])c2ncccc2c1.[Sb+3]
InChIInChI=1S/3C10H9NO.Sb/c3*1-7-5-8-3-2-4-11-10(8)9(12)6-7;/h3*2-6,12H,1H3;/q;;;+3/p-3
InChIKeyTYMLYKUHOCWESL-UHFFFAOYSA-K
XLogP4.47
TPSA107.85 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500596.30
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of antimony(3+);tris(6-methylquinolin-8-olate)?
The IUPAC name of antimony(3+);tris(6-methylquinolin-8-olate) (CID 3043305) is antimony(3+);tris(6-methylquinolin-8-olate).
What is the SMILES notation for antimony(3+);tris(6-methylquinolin-8-olate)?
The canonical SMILES for antimony(3+);tris(6-methylquinolin-8-olate) is Cc1cc([O-])c2ncccc2c1.Cc1cc([O-])c2ncccc2c1.Cc1cc([O-])c2ncccc2c1.[Sb+3].
What is the InChIKey of antimony(3+);tris(6-methylquinolin-8-olate)?
The InChIKey is TYMLYKUHOCWESL-UHFFFAOYSA-K. The full InChI is InChI=1S/3C10H9NO.Sb/c3*1-7-5-8-3-2-4-11-10(8)9(12)6-7;/h3*2-6,12H,1H3;/q;;;+3/p-3.
What are the key properties of antimony(3+);tris(6-methylquinolin-8-olate)?
antimony(3+);tris(6-methylquinolin-8-olate) has a molecular weight of 596.30 g/mol, XLogP of 4.47, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for antimony(3+);tris(6-methylquinolin-8-olate) is sourced from PubChem (CID 3043305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).