(4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane

C38H34Si2 — CID 4092032

IUPAC(4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane
SMILESCc1ccc([Si](c2ccccc2)(c2ccccc2)[Si](c2ccccc2)(c2ccccc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C38H34Si2/c1-31-23-27-37(28-24-31)39(33-15-7-3-8-16-33,34-17-9-4-10-18-34)40(35-19-11-5-12-20-35,36-21-13-6-14-22-36)38-29-25-32(2)26-30-38/h3-30H,1-2H3
InChIKeyNRBDIQMFDLFULN-UHFFFAOYSA-N
MW546.86 g/mol
LogP5.02
Rot. Bonds7

About (4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane

(4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane (PubChem CID 4092032) has the molecular formula C38H34Si2 and a molecular weight of 546.86 g/mol. Its IUPAC name is (4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane.

Molecular Properties

Compound Name(4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane
PubChem CID4092032
Molecular FormulaC38H34Si2
Molecular Weight546.86 g/mol
Exact Mass546.22
IUPAC Name(4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane
SMILESCc1ccc([Si](c2ccccc2)(c2ccccc2)[Si](c2ccccc2)(c2ccccc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C38H34Si2/c1-31-23-27-37(28-24-31)39(33-15-7-3-8-16-33,34-17-9-4-10-18-34)40(35-19-11-5-12-20-35,36-21-13-6-14-22-36)38-29-25-32(2)26-30-38/h3-30H,1-2H3
InChIKeyNRBDIQMFDLFULN-UHFFFAOYSA-N
XLogP5.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500546.86
LogP ≤ 55.02
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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Related Compounds

Octaphenylcyclotetrasilane
CID 70595
Hexaphenyldisilane
CID 74059
4,4'',4'''',4''''''-Silanetetrayltetrakis(1,1'-biphenyl)
CID 76878
1,1'-Biphenyl, 4-(triphenylsilyl)-
CID 76637
Diphenyldi(O-tolyl)silane
CID 3522575
Tetrakis(3-methylphenyl)plumbane
CID 4571693
Bis(phenylethynyl)diphenylsilane
CID 5213428
Tetraphenylphosphanium tetrakis(4-methylphenyl)borate(1-)
CID 23075127
1,4-Bis(triphenylsilyl)benzene
CID 297509
4,4''-(Diphenylsilylene)bis(1,1'-biphenyl)
CID 76636
Distannathiane, hexakis(phenylmethyl)-
CID 16683985
1,3-Bis(triphenylsilyl)benzene
CID 4351127

Frequently Asked Questions

What is the IUPAC name of (4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane?
The IUPAC name of (4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane (CID 4092032) is (4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane.
What is the SMILES notation for (4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane?
The canonical SMILES for (4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane is Cc1ccc([Si](c2ccccc2)(c2ccccc2)[Si](c2ccccc2)(c2ccccc2)c2ccc(C)cc2)cc1.
What is the InChIKey of (4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane?
The InChIKey is NRBDIQMFDLFULN-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H34Si2/c1-31-23-27-37(28-24-31)39(33-15-7-3-8-16-33,34-17-9-4-10-18-34)40(35-19-11-5-12-20-35,36-21-13-6-14-22-36)38-29-25-32(2)26-30-38/h3-30H,1-2H3.
What are the key properties of (4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane?
(4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane has a molecular weight of 546.86 g/mol, XLogP of 5.02, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylphenyl)-[(4-methylphenyl)-diphenylsilyl]-diphenylsilane is sourced from PubChem (CID 4092032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).