bis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane

C28H28Si — CID 20691834

IUPACbis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane
SMILESC[Si](C)(C1C2C=CC=CC2=C2C=CC=CC21)C1C2C=CC=CC2=C2C=CC=CC21
InChIInChI=1S/C28H28Si/c1-29(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/h3-18,23-28H,1-2H3
InChIKeyYOTNDFAJJJXVAE-UHFFFAOYSA-N
MW392.62 g/mol
LogP7.02
Rot. Bonds2

About bis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane

bis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane (PubChem CID 20691834) has the molecular formula C28H28Si and a molecular weight of 392.62 g/mol. Its IUPAC name is bis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane.

Molecular Properties

Compound Namebis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane
PubChem CID20691834
Molecular FormulaC28H28Si
Molecular Weight392.62 g/mol
Exact Mass392.20
IUPAC Namebis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane
SMILESC[Si](C)(C1C2C=CC=CC2=C2C=CC=CC21)C1C2C=CC=CC2=C2C=CC=CC21
InChIInChI=1S/C28H28Si/c1-29(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/h3-18,23-28H,1-2H3
InChIKeyYOTNDFAJJJXVAE-UHFFFAOYSA-N
XLogP7.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.62
LogP ≤ 57.02
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(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane?
The IUPAC name of bis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane (CID 20691834) is bis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane.
What is the SMILES notation for bis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane?
The canonical SMILES for bis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane is C[Si](C)(C1C2C=CC=CC2=C2C=CC=CC21)C1C2C=CC=CC2=C2C=CC=CC21.
What is the InChIKey of bis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane?
The InChIKey is YOTNDFAJJJXVAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28Si/c1-29(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/h3-18,23-28H,1-2H3.
What are the key properties of bis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane?
bis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane has a molecular weight of 392.62 g/mol, XLogP of 7.02, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(9,9a-dihydro-8aH-fluoren-9-yl)-dimethylsilane is sourced from PubChem (CID 20691834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).