chempirical

(Trimethylsilyl)imidazole

C6H12N2SiCAS 18156-74-6140.26 g/mol

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SiNN

Properties

Molecular formula
C6H12N2Si
Molar mass
140.26 g/mol
Exact mass
140.0770 Da
Density
0.96 g/mL
Melting point
105–106 °C
Boiling point
99 °C (at 14 Torr)
logP
1.57Crippen estimate
Polar surface area
17.8 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
18156-74-6
SMILES
C[Si](C)(C)n1ccnc1
InChIKey
YKFRUJSEPGHZFJ-UHFFFAOYSA-N
InChI
InChI=1S/C6H12N2Si/c1-9(2,3)8-5-4-7-6-8/h4-6H,1-3H3

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Type any one amount. The others follow from the molar mass and density.

Names and synonyms

12 names
  • 1H-Imidazole, 1-(trimethylsilyl)-
  • Imidazole, 1-(trimethylsilyl)-
  • 1-(Trimethylsilyl)-1H-imidazole
  • N-(Trimethylsilyl)imidazole
  • N-(Trimethylsilyl)imidazol
  • 1-(Trimethylsilyl)imidazole
  • TSIM
  • 1-Imidazolyltrimethylsilane
  • Trimethylimidazosilane
  • TMSI
  • NSC 139860
  • N-(Trimethylsilyl)-1H-imidazole

Work with (Trimethylsilyl)imidazole

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-[(1,1-Dimethylethyl)dimethylsilyl]-1H-imidazole54925-64-354 % similar 1-Methylimidazole616-47-740 % similar 1-Trimethylsilyl-1,2,4-triazole18293-54-436 % similar 1-(1-Methylethyl)-1H-imidazole4532-96-136 % similar 1-Ethylimidazole7098-07-936 % similar 1-Propylimidazole35203-44-233 % similar 1-(1H-Imidazol-1-yl)ethanone2466-76-432 % similar 1-(Methylsulfonyl)-1H-imidazole40736-26-332 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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