CID 157281307

C6H19BIr-5 — CID 157281307

IUPAC—
SMILESC.[B].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Ir]
InChIInChI=1S/CH4.5CH3.B.Ir/h1H4;5*1H3;;/q;5*-1;;
InChIKeyWATFEZDKGLPTQE-UHFFFAOYSA-N
MW294.25 g/mol
LogP2.50
Rot. Bonds

About CID 157281307

CID 157281307 (PubChem CID 157281307) has the molecular formula C6H19BIr-5 and a molecular weight of 294.25 g/mol.

Molecular Properties

Compound NameCID 157281307
PubChem CID157281307
Molecular FormulaC6H19BIr-5
Molecular Weight294.25 g/mol
Exact Mass295.12
IUPAC Name—
SMILESC.[B].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Ir]
InChIInChI=1S/CH4.5CH3.B.Ir/h1H4;5*1H3;;/q;5*-1;;
InChIKeyWATFEZDKGLPTQE-UHFFFAOYSA-N
XLogP2.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.25
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 157281307?
The IUPAC name of CID 157281307 (CID 157281307) is not available.
What is the SMILES notation for CID 157281307?
The canonical SMILES for CID 157281307 is C.[B].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Ir].
What is the InChIKey of CID 157281307?
The InChIKey is WATFEZDKGLPTQE-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4.5CH3.B.Ir/h1H4;5*1H3;;/q;5*-1;;.
What are the key properties of CID 157281307?
CID 157281307 has a molecular weight of 294.25 g/mol, XLogP of 2.50, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 157281307 is sourced from PubChem (CID 157281307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).