[bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane

C40H38Si2 — CID 5077893

IUPAC[bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane
SMILESCc1ccc([Si](c2ccccc2)(c2ccc(C)cc2)[Si](c2ccccc2)(c2ccc(C)cc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C40H38Si2/c1-31-15-23-37(24-16-31)41(35-11-7-5-8-12-35,38-25-17-32(2)18-26-38)42(36-13-9-6-10-14-36,39-27-19-33(3)20-28-39)40-29-21-34(4)22-30-40/h5-30H,1-4H3
InChIKeyGJGBHKUGVVDJNX-UHFFFAOYSA-N
MW574.92 g/mol
LogP5.64
Rot. Bonds7

About [bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane

[bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane (PubChem CID 5077893) has the molecular formula C40H38Si2 and a molecular weight of 574.92 g/mol. Its IUPAC name is [bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane.

Molecular Properties

Compound Name[bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane
PubChem CID5077893
Molecular FormulaC40H38Si2
Molecular Weight574.92 g/mol
Exact Mass574.25
IUPAC Name[bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane
SMILESCc1ccc([Si](c2ccccc2)(c2ccc(C)cc2)[Si](c2ccccc2)(c2ccc(C)cc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C40H38Si2/c1-31-15-23-37(24-16-31)41(35-11-7-5-8-12-35,38-25-17-32(2)18-26-38)42(36-13-9-6-10-14-36,39-27-19-33(3)20-28-39)40-29-21-34(4)22-30-40/h5-30H,1-4H3
InChIKeyGJGBHKUGVVDJNX-UHFFFAOYSA-N
XLogP5.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.92
LogP ≤ 55.64
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 [bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane?
The IUPAC name of [bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane (CID 5077893) is [bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane.
What is the SMILES notation for [bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane?
The canonical SMILES for [bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane is Cc1ccc([Si](c2ccccc2)(c2ccc(C)cc2)[Si](c2ccccc2)(c2ccc(C)cc2)c2ccc(C)cc2)cc1.
What is the InChIKey of [bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane?
The InChIKey is GJGBHKUGVVDJNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H38Si2/c1-31-15-23-37(24-16-31)41(35-11-7-5-8-12-35,38-25-17-32(2)18-26-38)42(36-13-9-6-10-14-36,39-27-19-33(3)20-28-39)40-29-21-34(4)22-30-40/h5-30H,1-4H3.
What are the key properties of [bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane?
[bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane has a molecular weight of 574.92 g/mol, XLogP of 5.64, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane is sourced from PubChem (CID 5077893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).