CID 162102234

C24H20BrSi — CID 162102234

IUPAC—
SMILESBrc1ccccc1.c1ccc([Si](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15Si.C6H5Br/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;7-6-4-2-1-3-5-6/h1-15H;1-5H
InChIKeyZFASHXSNLOFFLY-UHFFFAOYSA-N
MW416.41 g/mol
LogP4.65
Rot. Bonds3

About CID 162102234

CID 162102234 (PubChem CID 162102234) has the molecular formula C24H20BrSi and a molecular weight of 416.41 g/mol.

Molecular Properties

Compound NameCID 162102234
PubChem CID162102234
Molecular FormulaC24H20BrSi
Molecular Weight416.41 g/mol
Exact Mass415.05
IUPAC Name—
SMILESBrc1ccccc1.c1ccc([Si](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15Si.C6H5Br/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;7-6-4-2-1-3-5-6/h1-15H;1-5H
InChIKeyZFASHXSNLOFFLY-UHFFFAOYSA-N
XLogP4.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.41
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 162102234?
The IUPAC name of CID 162102234 (CID 162102234) is not available.
What is the SMILES notation for CID 162102234?
The canonical SMILES for CID 162102234 is Brc1ccccc1.c1ccc([Si](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of CID 162102234?
The InChIKey is ZFASHXSNLOFFLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Si.C6H5Br/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;7-6-4-2-1-3-5-6/h1-15H;1-5H.
What are the key properties of CID 162102234?
CID 162102234 has a molecular weight of 416.41 g/mol, XLogP of 4.65, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 162102234 is sourced from PubChem (CID 162102234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).