3-(Triethoxysilyl)propyl thiocyanate

C₁₀H₂₁NO₃SSiCAS 34708-08-2263.43 g/mol

Open in Covalent MOL file

Nitrile Silyl ether Sulfide

Properties

Molecular formula: C₁₀H₂₁NO₃SSi
Molar mass: 263.43 g/mol
Exact mass: 263.1011 Da
Density: 1.03 g/mL
Boiling point: 95 °C (at 0.1 Torr)
logP: 2.64Crippen estimate
Polar surface area: 51.5 Å²
H-bond donors / acceptors: 0 / 5
Rotatable bonds: 10

Hazards

Warning

H302 Harmful if swallowed95.7% of notifiers
H412 Harmful to aquatic life with long lasting effects93.5% of notifiers

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P273, P301+P317, P330, P501

Identifiers

CAS number

34708-08-2

SMILES

CCO[Si](CCCSC#N)(OCC)OCC

InChIKey

HKMVWLQFAYGKSI-UHFFFAOYSA-N

InChI

InChI=1S/C10H21NO3SSi/c1-4-12-16(13-5-2,14-6-3)9-7-8-15-10-11/h4-9H2,1-3H3

Weigh it out

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

Names and synonyms

9 names

(3-Thiocyanatopropyl)triethoxysilane
Thiocyanic acid, 3-(triethoxysilyl)propyl ester
Triethoxy(3-thiocyanatopropyl)silane
Si 264
(γ-Thiocyanatopropyl)triethoxysilane
HP 264
SIT 7908.0
(Thiocyanatopropyl)triethoxysilane
3-Triethoxysilylpropyl thiocyanate

Work with 3-(Triethoxysilyl)propyl thiocyanate

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

4,4,13,13-Tetraethoxy-3,14-dioxa-8,9-dithia-4,13-disilahexadecane56706-10-660 % similar Bis(triethoxysilylpropyl)tetrasulfide40372-72-356 % similar 3-Cyanopropyltriethoxysilane1067-47-655 % similar (2-Cyanoethyl)triethoxysilane919-31-348 % similar Butyl thiocyanate628-83-148 % similar Pentyltriethoxysilane2761-24-247 % similar Pentyl thiocyanate32446-40-547 % similar Bis(triethoxysilyl)ethane16068-37-446 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook