chloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane

C24H27ClSi — CID 88962238

IUPACchloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane
SMILESCc1cc(C)cc([Si](Cl)(c2cccc(C)c2C)c2cccc(C)c2C)c1
InChIInChI=1S/C24H27ClSi/c1-16-13-17(2)15-22(14-16)26(25,23-11-7-9-18(3)20(23)5)24-12-8-10-19(4)21(24)6/h7-15H,1-6H3
InChIKeyINIBQSJGYAGZAF-UHFFFAOYSA-N
MW379.02 g/mol
LogP4.74
Rot. Bonds3

About chloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane

chloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane (PubChem CID 88962238) has the molecular formula C24H27ClSi and a molecular weight of 379.02 g/mol. Its IUPAC name is chloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane.

Molecular Properties

Compound Namechloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane
PubChem CID88962238
Molecular FormulaC24H27ClSi
Molecular Weight379.02 g/mol
Exact Mass378.16
IUPAC Namechloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane
SMILESCc1cc(C)cc([Si](Cl)(c2cccc(C)c2C)c2cccc(C)c2C)c1
InChIInChI=1S/C24H27ClSi/c1-16-13-17(2)15-22(14-16)26(25,23-11-7-9-18(3)20(23)5)24-12-8-10-19(4)21(24)6/h7-15H,1-6H3
InChIKeyINIBQSJGYAGZAF-UHFFFAOYSA-N
XLogP4.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.02
LogP ≤ 54.74
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-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane?
The IUPAC name of chloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane (CID 88962238) is chloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane.
What is the SMILES notation for chloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane?
The canonical SMILES for chloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane is Cc1cc(C)cc([Si](Cl)(c2cccc(C)c2C)c2cccc(C)c2C)c1.
What is the InChIKey of chloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane?
The InChIKey is INIBQSJGYAGZAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27ClSi/c1-16-13-17(2)15-22(14-16)26(25,23-11-7-9-18(3)20(23)5)24-12-8-10-19(4)21(24)6/h7-15H,1-6H3.
What are the key properties of chloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane?
chloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane has a molecular weight of 379.02 g/mol, XLogP of 4.74, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-bis(2,3-dimethylphenyl)-(3,5-dimethylphenyl)silane is sourced from PubChem (CID 88962238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).