2-(Acetyloxy)-2-methylpropanoyl bromide

C₆H₉BrO₃CAS 40635-67-4209.04 g/mol

Open in Covalent MOL file

Acyl halide Ester

Properties

Molecular formula: C₆H₉BrO₃
Molar mass: 209.04 g/mol
Exact mass: 207.9735 Da
logP: 1.25Crippen estimate
Polar surface area: 43.4 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

Identifiers

CAS number

40635-67-4

SMILES

CC(=O)OC(C)(C)C(=O)Br

InChIKey

OOKAXSHFTDPZHP-UHFFFAOYSA-N

InChI

InChI=1S/C6H9BrO3/c1-4(8)10-6(2,3)5(7)9/h1-3H3

Weigh it out

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

Names and synonyms

7 names

Propanoyl bromide, 2-(acetyloxy)-2-methyl-
2-Acetoxyisobutyryl bromide
α-Acetoxyisobutyryl bromide
Mattock's bromide
2-Acetoxy-2-methylpropanoyl bromide
1-Bromocarbonyl-1-methylethyl acetate
2-Acetoxy-2-methylpropionyl bromide

Work with 2-(Acetyloxy)-2-methylpropanoyl bromide

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

2-(Acetyloxy)-2-methylpropanoyl chloride40635-66-355 % similar tert-Butyl acetate540-88-550 % similar 2-Bromoisobutyryl bromide20769-85-141 % similar Acetic anhydride108-24-738 % similar tert-Butyl peroxyacetate107-71-137 % similar Methyltriacetoxysilane4253-34-336 % similar Isopropenyl acetate108-22-534 % similar Di-tert-butoxydiacetoxysilane13170-23-534 % similar

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

Elsewhere

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