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CAS 939-48-0

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Isopropyl benzoate

Description:
Isopropyl benzoate, with the CAS number 939-48-0, is an organic compound classified as an ester. It is formed from the reaction of isopropanol and benzoic acid. This colorless to pale yellow liquid is characterized by a pleasant, fruity odor, making it useful in the fragrance and flavoring industries. Isopropyl benzoate is moderately soluble in water but highly soluble in organic solvents such as ethanol and ether. Its chemical formula is C10H12O2, and it has a molecular weight of approximately 164.2 g/mol. The compound exhibits low toxicity, which contributes to its application in cosmetics and personal care products as a solvent and emollient. Additionally, isopropyl benzoate has potential uses in the pharmaceutical industry, particularly in drug formulation as a carrier for active ingredients. It is important to handle this substance with care, following appropriate safety guidelines, as with all chemical compounds.
Formula:C10H12O2
InChI:InChI=1S/C10H12O2/c1-8(2)12-10(11)9-6-4-3-5-7-9/h3-8H,1-2H3
InChI key:InChIKey=FEXQDZTYJVXMOS-UHFFFAOYSA-N
SMILES:C(OC(C)C)(=O)C1=CC=CC=C1
Synonyms:
  • 1-Methylethyl benzoate
  • Benzoic acid iso-propyl ester
  • Benzoic acid isopropyl ester
  • Benzoic acid, 1-methylethyl ester
  • Benzoicacidisoprpylester
  • Propan-2-Yl Benzoate
  • Isopropyl benzoate
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