CID 135045851

C16H22BrCuLi2Si2+2 — CID 135045851

IUPAC—
SMILESC[Si](C)c1ccccc1.C[Si](C)c1ccccc1.[Cu]Br.[Li+].[Li+]
InChIInChI=1S/2C8H11Si.BrH.Cu.2Li/c2*1-9(2)8-6-4-3-5-7-8;;;;/h2*3-7H,1-2H3;1H;;;/q;;;3*+1/p-1
InChIKeyLYHAMWWDYODBKY-UHFFFAOYSA-M
MW427.86 g/mol
LogP-1.85
Rot. Bonds2

About CID 135045851

CID 135045851 (PubChem CID 135045851) has the molecular formula C16H22BrCuLi2Si2+2 and a molecular weight of 427.86 g/mol.

Molecular Properties

Compound NameCID 135045851
PubChem CID135045851
Molecular FormulaC16H22BrCuLi2Si2+2
Molecular Weight427.86 g/mol
Exact Mass426.00
IUPAC Name—
SMILESC[Si](C)c1ccccc1.C[Si](C)c1ccccc1.[Cu]Br.[Li+].[Li+]
InChIInChI=1S/2C8H11Si.BrH.Cu.2Li/c2*1-9(2)8-6-4-3-5-7-8;;;;/h2*3-7H,1-2H3;1H;;;/q;;;3*+1/p-1
InChIKeyLYHAMWWDYODBKY-UHFFFAOYSA-M
XLogP-1.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.86
LogP ≤ 5-1.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'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 135045851?
The IUPAC name of CID 135045851 (CID 135045851) is not available.
What is the SMILES notation for CID 135045851?
The canonical SMILES for CID 135045851 is C[Si](C)c1ccccc1.C[Si](C)c1ccccc1.[Cu]Br.[Li+].[Li+].
What is the InChIKey of CID 135045851?
The InChIKey is LYHAMWWDYODBKY-UHFFFAOYSA-M. The full InChI is InChI=1S/2C8H11Si.BrH.Cu.2Li/c2*1-9(2)8-6-4-3-5-7-8;;;;/h2*3-7H,1-2H3;1H;;;/q;;;3*+1/p-1.
What are the key properties of CID 135045851?
CID 135045851 has a molecular weight of 427.86 g/mol, XLogP of -1.85, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 135045851 is sourced from PubChem (CID 135045851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).