1-tert-butyl-5,5,10,10-tetramethylsilanthrene

C20H28Si2 — CID 174063391

IUPAC1-tert-butyl-5,5,10,10-tetramethylsilanthrene
SMILESCC(C)(C)c1cccc2c1[Si](C)(C)c1ccccc1[Si]2(C)C
InChIInChI=1S/C20H28Si2/c1-20(2,3)15-11-10-14-18-19(15)22(6,7)17-13-9-8-12-16(17)21(18,4)5/h8-14H,1-7H3
InChIKeyYMLICNHKIJQMQJ-UHFFFAOYSA-N
MW324.62 g/mol
LogP2.94
Rot. Bonds

About 1-tert-butyl-5,5,10,10-tetramethylsilanthrene

1-tert-butyl-5,5,10,10-tetramethylsilanthrene (PubChem CID 174063391) has the molecular formula C20H28Si2 and a molecular weight of 324.62 g/mol. Its IUPAC name is 1-tert-butyl-5,5,10,10-tetramethylsilanthrene.

Molecular Properties

Compound Name1-tert-butyl-5,5,10,10-tetramethylsilanthrene
PubChem CID174063391
Molecular FormulaC20H28Si2
Molecular Weight324.62 g/mol
Exact Mass324.17
IUPAC Name1-tert-butyl-5,5,10,10-tetramethylsilanthrene
SMILESCC(C)(C)c1cccc2c1[Si](C)(C)c1ccccc1[Si]2(C)C
InChIInChI=1S/C20H28Si2/c1-20(2,3)15-11-10-14-18-19(15)22(6,7)17-13-9-8-12-16(17)21(18,4)5/h8-14H,1-7H3
InChIKeyYMLICNHKIJQMQJ-UHFFFAOYSA-N
XLogP2.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.62
LogP ≤ 52.94
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 1-tert-butyl-5,5,10,10-tetramethylsilanthrene?
The IUPAC name of 1-tert-butyl-5,5,10,10-tetramethylsilanthrene (CID 174063391) is 1-tert-butyl-5,5,10,10-tetramethylsilanthrene.
What is the SMILES notation for 1-tert-butyl-5,5,10,10-tetramethylsilanthrene?
The canonical SMILES for 1-tert-butyl-5,5,10,10-tetramethylsilanthrene is CC(C)(C)c1cccc2c1[Si](C)(C)c1ccccc1[Si]2(C)C.
What is the InChIKey of 1-tert-butyl-5,5,10,10-tetramethylsilanthrene?
The InChIKey is YMLICNHKIJQMQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28Si2/c1-20(2,3)15-11-10-14-18-19(15)22(6,7)17-13-9-8-12-16(17)21(18,4)5/h8-14H,1-7H3.
What are the key properties of 1-tert-butyl-5,5,10,10-tetramethylsilanthrene?
1-tert-butyl-5,5,10,10-tetramethylsilanthrene has a molecular weight of 324.62 g/mol, XLogP of 2.94, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-5,5,10,10-tetramethylsilanthrene is sourced from PubChem (CID 174063391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).