Propylsilanetriyl triacetate

C₉H₁₆O₆SiCAS 17865-07-5248.31 g/mol

Open in Covalent MOL file

Silyl ether

Properties

Molecular formula: C₉H₁₆O₆Si
Molar mass: 248.31 g/mol
Exact mass: 248.0716 Da
Density: 1.119 g/mL (at 20 °C)
Boiling point: 127–131 °C (at 20 Torr)
logP: 1.02Crippen estimate
Polar surface area: 78.9 Å²
H-bond donors / acceptors: 0 / 6
Rotatable bonds: 5

Hazards

Danger

H302 Harmful if swallowed12.4% of notifiers
H314 Causes severe skin burns and eye damage77.5% of notifiers
H315 Causes skin irritation22.5% of notifiers
H318 Causes serious eye damage58.4% of notifiers
H319 Causes serious eye irritation21.9% of notifiers
H335 May cause respiratory irritation21.9% of notifiers

Aggregated from 178 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, P501

Identifiers

CAS number

17865-07-5

SMILES

CCC[Si](OC(C)=O)(OC(C)=O)OC(C)=O

InChIKey

DKGZKEKMWBGTIB-UHFFFAOYSA-N

InChI

InChI=1S/C9H16O6Si/c1-5-6-16(13-7(2)10,14-8(3)11)15-9(4)12/h5-6H2,1-4H3

Weigh it out

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

Names and synonyms

3 names

Silanetriol, 1-propyl-, 1,1,1-triacetate
Silanetriol, propyl-, triacetate
Propyltriacetoxysilane

Work with Propylsilanetriyl triacetate

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

Ethyltriacetoxysilane17689-77-960 % similar Propyl acetate109-60-448 % similar Tetraacetoxysilane562-90-346 % similar Butyl acetate123-86-445 % similar Amyl acetate628-63-743 % similar Propyltrimethoxysilane1067-25-042 % similar Dimethyldiacetoxysilane2182-66-342 % similar Trimethylsilyl acetate2754-27-042 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook