chempirical

Trimethylsilyl isocyanate

C4H9NOSiCAS 1118-02-1115.21 g/mol

Open in Covalent MOL file
SiNO
Isocyanate

Properties

Molecular formula
C4H9NOSi
Molar mass
115.21 g/mol
Exact mass
115.0453 Da
Density
0.87 g/mL
Melting point
12–12.5 °C
Boiling point
91 °C
logP
1.16Crippen estimate
Polar surface area
29.4 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
1118-02-1
SMILES
C[Si](C)(C)N=C=O
InChIKey
NIZHERJWXFHGGU-UHFFFAOYSA-N
InChI
InChI=1S/C4H9NOSi/c1-7(2,3)5-4-6/h1-3H3

Weigh it out

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

Names and synonyms

6 names
  • Silane, isocyanatotrimethyl-
  • Isocyanatotrimethylsilane
  • Isocyanic acid, trimethylsilyl ester
  • Trimethylisocyanatosilane
  • Orgatix SI 130
  • Trimethysilyl isocyanate

Work with Trimethylsilyl isocyanate

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Trimethylsilyl isothiocyanate2290-65-543 % similar Methyl isocyanate624-83-935 % similar Ethyl isocyanate109-90-030 % similar tert-Butyl isocyanate1609-86-530 % similar Isopropyl isocyanate1795-48-830 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook