CID 119078488

C34H26Si2 — CID 119078488

IUPAC—
SMILESc1ccc([Si](c2ccccc2)c2cccc3cccc([Si](c4ccccc4)c4ccccc4)c23)cc1
InChIInChI=1S/C34H26Si2/c1-5-17-28(18-6-1)35(29-19-7-2-8-20-29)32-25-13-15-27-16-14-26-33(34(27)32)36(30-21-9-3-10-22-30)31-23-11-4-12-24-31/h1-26H
InChIKeyWJTMCEXLUHCVJV-UHFFFAOYSA-N
MW490.75 g/mol
LogP3.87
Rot. Bonds6

About CID 119078488

CID 119078488 (PubChem CID 119078488) has the molecular formula C34H26Si2 and a molecular weight of 490.75 g/mol.

Molecular Properties

Compound NameCID 119078488
PubChem CID119078488
Molecular FormulaC34H26Si2
Molecular Weight490.75 g/mol
Exact Mass490.16
IUPAC Name—
SMILESc1ccc([Si](c2ccccc2)c2cccc3cccc([Si](c4ccccc4)c4ccccc4)c23)cc1
InChIInChI=1S/C34H26Si2/c1-5-17-28(18-6-1)35(29-19-7-2-8-20-29)32-25-13-15-27-16-14-26-33(34(27)32)36(30-21-9-3-10-22-30)31-23-11-4-12-24-31/h1-26H
InChIKeyWJTMCEXLUHCVJV-UHFFFAOYSA-N
XLogP3.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500490.75
LogP ≤ 53.87
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 119078488?
The IUPAC name of CID 119078488 (CID 119078488) is not available.
What is the SMILES notation for CID 119078488?
The canonical SMILES for CID 119078488 is c1ccc([Si](c2ccccc2)c2cccc3cccc([Si](c4ccccc4)c4ccccc4)c23)cc1.
What is the InChIKey of CID 119078488?
The InChIKey is WJTMCEXLUHCVJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H26Si2/c1-5-17-28(18-6-1)35(29-19-7-2-8-20-29)32-25-13-15-27-16-14-26-33(34(27)32)36(30-21-9-3-10-22-30)31-23-11-4-12-24-31/h1-26H.
What are the key properties of CID 119078488?
CID 119078488 has a molecular weight of 490.75 g/mol, XLogP of 3.87, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 119078488 is sourced from PubChem (CID 119078488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).