dibromo-bis[ditert-butyl(methyl)silyl]silane

C18H42Br2Si3 — CID 11156337

IUPACdibromo-bis[ditert-butyl(methyl)silyl]silane
SMILESCC(C)(C)[Si](C)(C(C)(C)C)[Si](Br)(Br)[Si](C)(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C18H42Br2Si3/c1-15(2,3)21(13,16(4,5)6)23(19,20)22(14,17(7,8)9)18(10,11)12/h1-14H3
InChIKeyLYYBQHJLOUSQAA-UHFFFAOYSA-N
MW502.60 g/mol
LogP8.73
Rot. Bonds2

About dibromo-bis[ditert-butyl(methyl)silyl]silane

dibromo-bis[ditert-butyl(methyl)silyl]silane (PubChem CID 11156337) has the molecular formula C18H42Br2Si3 and a molecular weight of 502.60 g/mol. Its IUPAC name is dibromo-bis[ditert-butyl(methyl)silyl]silane.

Molecular Properties

Compound Namedibromo-bis[ditert-butyl(methyl)silyl]silane
PubChem CID11156337
Molecular FormulaC18H42Br2Si3
Molecular Weight502.60 g/mol
Exact Mass500.10
IUPAC Namedibromo-bis[ditert-butyl(methyl)silyl]silane
SMILESCC(C)(C)[Si](C)(C(C)(C)C)[Si](Br)(Br)[Si](C)(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C18H42Br2Si3/c1-15(2,3)21(13,16(4,5)6)23(19,20)22(14,17(7,8)9)18(10,11)12/h1-14H3
InChIKeyLYYBQHJLOUSQAA-UHFFFAOYSA-N
XLogP8.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500502.60
LogP ≤ 58.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dibromo-bis[ditert-butyl(methyl)silyl]silane?
The IUPAC name of dibromo-bis[ditert-butyl(methyl)silyl]silane (CID 11156337) is dibromo-bis[ditert-butyl(methyl)silyl]silane.
What is the SMILES notation for dibromo-bis[ditert-butyl(methyl)silyl]silane?
The canonical SMILES for dibromo-bis[ditert-butyl(methyl)silyl]silane is CC(C)(C)[Si](C)(C(C)(C)C)[Si](Br)(Br)[Si](C)(C(C)(C)C)C(C)(C)C.
What is the InChIKey of dibromo-bis[ditert-butyl(methyl)silyl]silane?
The InChIKey is LYYBQHJLOUSQAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H42Br2Si3/c1-15(2,3)21(13,16(4,5)6)23(19,20)22(14,17(7,8)9)18(10,11)12/h1-14H3.
What are the key properties of dibromo-bis[ditert-butyl(methyl)silyl]silane?
dibromo-bis[ditert-butyl(methyl)silyl]silane has a molecular weight of 502.60 g/mol, XLogP of 8.73, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dibromo-bis[ditert-butyl(methyl)silyl]silane is sourced from PubChem (CID 11156337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).