Methyl (trimethylsilyl)acetate

C₆H₁₄O₂SiCAS 2916-76-9146.26 g/mol

Open in Covalent MOL file

Ester

Properties

Molecular formula: C₆H₁₄O₂Si
Molar mass: 146.26 g/mol
Exact mass: 146.0763 Da
Density: 0.89 g/mL
Boiling point: 62–64 °C (at 50 Torr)
logP: 1.50Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 2

Hazards

Warning

H226 Flammable liquid and vapor100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

2916-76-9

SMILES

COC(=O)C[Si](C)(C)C

InChIKey

JIHUZDFFYVRXKP-UHFFFAOYSA-N

InChI

InChI=1S/C6H14O2Si/c1-8-6(7)5-9(2,3)4/h5H2,1-4H3

Weigh it out

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

Names and synonyms

5 names

Acetic acid, 2-(trimethylsilyl)-, methyl ester
Acetic acid, (trimethylsilyl)-, methyl ester
Methyl trimethylsilylacetate
NSC 601813
Methyl 2-(trimethylsilyl)acetate

Work with Methyl (trimethylsilyl)acetate

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

Ethyl (trimethylsilyl)acetate4071-88-956 % similar Dimethyl succinate106-65-052 % similar Dimethyl malonate108-59-852 % similar Dimethyl glutarate1119-40-050 % similar Methyl propionate554-12-148 % similar Dimethyl adipate627-93-048 % similar Dimethyl sebacate106-79-646 % similar Dimethyl octadecanedioate1472-93-146 % similar

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

Same formula

(Trimethylsilyl)methyl acetate2917-65-9 Trimethylsilylpropanoic acid5683-30-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook