Isobutyl salicylate

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Catalog Number ACM87194
Product Name Isobutyl salicylate
CAS Number 87-19-4
Structure Isobutyl salicylate
Description Isobutyl salicylate is used as a reactant in the new boron(III)-catalyzed esterifications and amidations of carboxylic acids and Ritter addition reaction.
IUPAC Name 2-Methylpropyl 2-hydroxybenzoate
Synonyms Salicylic acid isobutyl
Molecular Weight 194.23
Molecular Formula C11H14O3
Canonical SMILES CC(C)COC(=O)C1=CC=CC=C1O
Inchi InChI=1S/C11H14O3/c1-8(2)7-14-11(13)9-5-3-4-6-10(9)12/h3-6,8,12H,7H2,1-2H3
InChIKey PTXDBYSCVQQBNF-UHFFFAOYSA-N
Boiling Point 267 °C
Melting Point 5.9 °C
Flash Point 230 °F
Purity 95%+
Density 1.064 g/mL at 25 °C(lit.)
Solubility Insoluble in water, glycerol; soluble in organic solvents, oils
Appearance Colorless to pale yellow clear liquid (est)
Physical State Liquid
Refractive Index n20/D 1.509(lit.)

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