bis(9H-fluoren-9-yl)-dimethylsilane

C56H48Si2 — CID 139176498

IUPACbis(9H-fluoren-9-yl)-dimethylsilane
SMILESC[Si](C)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21.C[Si](C)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21
InChIInChI=1S/2C28H24Si/c2*1-29(2,27-23-15-7-3-11-19(23)20-12-4-8-16-24(20)27)28-25-17-9-5-13-21(25)22-14-6-10-18-26(22)28/h2*3-18,27-28H,1-2H3
InChIKeyTWORBXGVNUCRFN-UHFFFAOYSA-N
MW777.17 g/mol
LogP14.80
Rot. Bonds4

About bis(9H-fluoren-9-yl)-dimethylsilane

bis(9H-fluoren-9-yl)-dimethylsilane (PubChem CID 139176498) has the molecular formula C56H48Si2 and a molecular weight of 777.17 g/mol. Its IUPAC name is bis(9H-fluoren-9-yl)-dimethylsilane.

Molecular Properties

Compound Namebis(9H-fluoren-9-yl)-dimethylsilane
PubChem CID139176498
Molecular FormulaC56H48Si2
Molecular Weight777.17 g/mol
Exact Mass776.33
IUPAC Namebis(9H-fluoren-9-yl)-dimethylsilane
SMILESC[Si](C)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21.C[Si](C)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21
InChIInChI=1S/2C28H24Si/c2*1-29(2,27-23-15-7-3-11-19(23)20-12-4-8-16-24(20)27)28-25-17-9-5-13-21(25)22-14-6-10-18-26(22)28/h2*3-18,27-28H,1-2H3
InChIKeyTWORBXGVNUCRFN-UHFFFAOYSA-N
XLogP14.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500777.17
LogP ≤ 514.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(9H-fluoren-9-yl)-dimethylsilane?
The IUPAC name of bis(9H-fluoren-9-yl)-dimethylsilane (CID 139176498) is bis(9H-fluoren-9-yl)-dimethylsilane.
What is the SMILES notation for bis(9H-fluoren-9-yl)-dimethylsilane?
The canonical SMILES for bis(9H-fluoren-9-yl)-dimethylsilane is C[Si](C)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21.C[Si](C)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21.
What is the InChIKey of bis(9H-fluoren-9-yl)-dimethylsilane?
The InChIKey is TWORBXGVNUCRFN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C28H24Si/c2*1-29(2,27-23-15-7-3-11-19(23)20-12-4-8-16-24(20)27)28-25-17-9-5-13-21(25)22-14-6-10-18-26(22)28/h2*3-18,27-28H,1-2H3.
What are the key properties of bis(9H-fluoren-9-yl)-dimethylsilane?
bis(9H-fluoren-9-yl)-dimethylsilane has a molecular weight of 777.17 g/mol, XLogP of 14.80, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(9H-fluoren-9-yl)-dimethylsilane is sourced from PubChem (CID 139176498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).