trimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide

C7H15BrN2Si — CID 66885126

IUPACtrimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide
SMILESC[n+]1ccn([Si](C)(C)C)c1.[Br-]
InChIInChI=1S/C7H15N2Si.BrH/c1-8-5-6-9(7-8)10(2,3)4;/h5-7H,1-4H3;1H/q+1;/p-1
InChIKeyGLJYONDFOCEURK-UHFFFAOYSA-M
MW235.20 g/mol
LogP-2.00
Rot. Bonds1

About trimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide

trimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide (PubChem CID 66885126) has the molecular formula C7H15BrN2Si and a molecular weight of 235.20 g/mol. Its IUPAC name is trimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide.

Molecular Properties

Compound Nametrimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide
PubChem CID66885126
Molecular FormulaC7H15BrN2Si
Molecular Weight235.20 g/mol
Exact Mass234.02
IUPAC Nametrimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide
SMILESC[n+]1ccn([Si](C)(C)C)c1.[Br-]
InChIInChI=1S/C7H15N2Si.BrH/c1-8-5-6-9(7-8)10(2,3)4;/h5-7H,1-4H3;1H/q+1;/p-1
InChIKeyGLJYONDFOCEURK-UHFFFAOYSA-M
XLogP-2.00
TPSA8.81 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.20
LogP ≤ 5-2.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide?
The IUPAC name of trimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide (CID 66885126) is trimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide.
What is the SMILES notation for trimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide?
The canonical SMILES for trimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide is C[n+]1ccn([Si](C)(C)C)c1.[Br-].
What is the InChIKey of trimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide?
The InChIKey is GLJYONDFOCEURK-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H15N2Si.BrH/c1-8-5-6-9(7-8)10(2,3)4;/h5-7H,1-4H3;1H/q+1;/p-1.
What are the key properties of trimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide?
trimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide has a molecular weight of 235.20 g/mol, XLogP of -2.00, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(3-methylimidazol-3-ium-1-yl)silane bromide is sourced from PubChem (CID 66885126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).