chempirical

Trimethylsilyl isothiocyanate

C4H9NSSiCAS 2290-65-5131.27 g/mol

Open in Covalent MOL file
SiNS
Isothiocyanate

Properties

Molecular formula
C4H9NSSi
Molar mass
131.27 g/mol
Exact mass
131.0225 Da
Density
0.93 g/mL
Melting point
−33 °C
Boiling point
144 °C
logP
1.92Crippen estimate
Polar surface area
12.4 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
2290-65-5
SMILES
C[Si](C)(C)N=C=S
InChIKey
XLTUPERVRFLGLJ-UHFFFAOYSA-N
InChI
InChI=1S/C4H9NSSi/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

3 names
  • Silane, isothiocyanatotrimethyl-
  • Isothiocyanatotrimethylsilane
  • Trimethylisothiocyanatosilane

Work with Trimethylsilyl isothiocyanate

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 isocyanate1118-02-143 % similar Isopropyl isothiocyanate2253-73-830 % similar Ethyl isothiocyanate542-85-830 % similar tert-Butyl isothiocyanate590-42-130 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia