Isobutyl salicylate

Catalog	ACM87194
CAS	87-19-4
Structure
Description	Isobutyl salicylate is used as a reactant in the new boron(III)-catalyzed esterifications and amidations of carboxylic acids and Ritter addition reaction.
Synonyms	Salicylic acid isobutyl
IUPAC Name	2-Methylpropyl 2-hydroxybenzoate
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
InChI Key	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)
Exact Mass	194.094294304
Monoisotopic Mass	194.094294304
Physical State	Liquid
Refractive Index	n20/D 1.509(lit.)
Storage Conditions	Keep tightly closed.
Topological Polar Surface Area	46.5 Ų