trinaphthalen-1-ylstibane

C30H21Sb — CID 4998673

IUPACtrinaphthalen-1-ylstibane
SMILESc1ccc2c([Sb](c3cccc4ccccc34)c3cccc4ccccc34)cccc2c1
InChIInChI=1S/3C10H7.Sb/c3*1-2-6-10-8-4-3-7-9(10)5-1;/h3*1-7H;
InChIKeyFXMLATQFGNVJFQ-UHFFFAOYSA-N
MW503.26 g/mol
LogP5.66
Rot. Bonds3

About trinaphthalen-1-ylstibane

trinaphthalen-1-ylstibane (PubChem CID 4998673) has the molecular formula C30H21Sb and a molecular weight of 503.26 g/mol. Its IUPAC name is trinaphthalen-1-ylstibane.

Molecular Properties

Compound Nametrinaphthalen-1-ylstibane
PubChem CID4998673
Molecular FormulaC30H21Sb
Molecular Weight503.26 g/mol
Exact Mass502.07
IUPAC Nametrinaphthalen-1-ylstibane
SMILESc1ccc2c([Sb](c3cccc4ccccc34)c3cccc4ccccc34)cccc2c1
InChIInChI=1S/3C10H7.Sb/c3*1-2-6-10-8-4-3-7-9(10)5-1;/h3*1-7H;
InChIKeyFXMLATQFGNVJFQ-UHFFFAOYSA-N
XLogP5.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500503.26
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 trinaphthalen-1-ylstibane?
The IUPAC name of trinaphthalen-1-ylstibane (CID 4998673) is trinaphthalen-1-ylstibane.
What is the SMILES notation for trinaphthalen-1-ylstibane?
The canonical SMILES for trinaphthalen-1-ylstibane is c1ccc2c([Sb](c3cccc4ccccc34)c3cccc4ccccc34)cccc2c1.
What is the InChIKey of trinaphthalen-1-ylstibane?
The InChIKey is FXMLATQFGNVJFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C10H7.Sb/c3*1-2-6-10-8-4-3-7-9(10)5-1;/h3*1-7H;.
What are the key properties of trinaphthalen-1-ylstibane?
trinaphthalen-1-ylstibane has a molecular weight of 503.26 g/mol, XLogP of 5.66, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trinaphthalen-1-ylstibane is sourced from PubChem (CID 4998673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).