chloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane

C26H35ClSi3 — CID 88962825

IUPACchloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane
SMILESCc1cc(C)cc([Si](Cl)(c2cccc([Si](C)(C)C)c2)c2cccc([Si](C)(C)C)c2)c1
InChIInChI=1S/C26H35ClSi3/c1-20-15-21(2)17-26(16-20)30(27,24-13-9-11-22(18-24)28(3,4)5)25-14-10-12-23(19-25)29(6,7)8/h9-19H,1-8H3
InChIKeyMWMAAJLPZFJYQJ-UHFFFAOYSA-N
MW467.28 g/mol
LogP4.60
Rot. Bonds5

About chloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane

chloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane (PubChem CID 88962825) has the molecular formula C26H35ClSi3 and a molecular weight of 467.28 g/mol. Its IUPAC name is chloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane.

Molecular Properties

Compound Namechloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane
PubChem CID88962825
Molecular FormulaC26H35ClSi3
Molecular Weight467.28 g/mol
Exact Mass466.17
IUPAC Namechloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane
SMILESCc1cc(C)cc([Si](Cl)(c2cccc([Si](C)(C)C)c2)c2cccc([Si](C)(C)C)c2)c1
InChIInChI=1S/C26H35ClSi3/c1-20-15-21(2)17-26(16-20)30(27,24-13-9-11-22(18-24)28(3,4)5)25-14-10-12-23(19-25)29(6,7)8/h9-19H,1-8H3
InChIKeyMWMAAJLPZFJYQJ-UHFFFAOYSA-N
XLogP4.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.28
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of chloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane?
The IUPAC name of chloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane (CID 88962825) is chloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane.
What is the SMILES notation for chloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane?
The canonical SMILES for chloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane is Cc1cc(C)cc([Si](Cl)(c2cccc([Si](C)(C)C)c2)c2cccc([Si](C)(C)C)c2)c1.
What is the InChIKey of chloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane?
The InChIKey is MWMAAJLPZFJYQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H35ClSi3/c1-20-15-21(2)17-26(16-20)30(27,24-13-9-11-22(18-24)28(3,4)5)25-14-10-12-23(19-25)29(6,7)8/h9-19H,1-8H3.
What are the key properties of chloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane?
chloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane has a molecular weight of 467.28 g/mol, XLogP of 4.60, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(3,5-dimethylphenyl)-bis(3-trimethylsilylphenyl)silane is sourced from PubChem (CID 88962825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).