tert-Butyl peroxyacetate

C₆H₁₂O₃CAS 107-71-1132.16 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₁₂O₃
Molar mass: 132.16 g/mol
Exact mass: 132.0786 Da
Density: 0.9415 g/mL (at 20 °C)
Boiling point: 42–43 °C (at 11 Torr)
logP: 1.28Crippen estimate
Polar surface area: 35.5 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Identifiers

CAS number

107-71-1

SMILES

CC(=O)OOC(C)(C)C

InChIKey

SWAXTRYEYUTSAP-UHFFFAOYSA-N

InChI

InChI=1S/C6H12O3/c1-5(7)8-9-6(2,3)4/h1-4H3

Weigh it out

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

Names and synonyms

15 names · show all

Ethaneperoxoic acid, 1,1-dimethylethyl ester
Peroxyacetic acid, tert-butyl ester
tert-Butyl peracetate
Lupersol 70
Acetyl tert-butyl peroxide
Perbutyl A
Kayabutyl A
Trigonox F-C 50
Kayabutyl A 50T
Esperox 12MD
NSC 118417
Luperox 7M75
Trigonox F
Luperox 7M50
tert-Pentyl peroxy acetate

Work with tert-Butyl peroxyacetate

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

Same formula

Solketal100-79-8 2,5-Bis[hydroxymethyl]tetrahydrofuran104-80-3 Propylene glycol methyl ether acetate108-65-6 2-Ethoxyethyl acetate111-15-9 3-(Allyloxy)-1,2-propanediol123-34-2 Paraldehyde123-63-7 L-Leucic acid13748-90-8 Methyl 3-hydroxy-2,2-dimethylpropanoate14002-80-3

Elsewhere

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