W292605

Isopropyl acetate

≥99%, FCC

• Synonym(s): Acetic acid isopropyl ester
• Linear Formula: CH₃COOCH(CH₃)₂
• CAS Number: 108-21-4
• Molecular Weight: 102.13
• FEMA Number: 2926
• Beilstein: 1740761
• EC Number: 203-561-1
• Council of Europe no.: 193
• MDL number: MFCD00008877
• UNSPSC Code: 12164502
• PubChem Substance ID: 24901399
• Flavis number: 9.003
• NACRES: NA.21
• grade: Fragrance grade; Halal; Kosher
• biological source: synthetic
• food allergen: no known allergens

Properties

• biological source: synthetic
• Quality Level: 400
• grade: Fragrance grade; Halal; Kosher
• Agency: follows IFRA guidelines; meets purity specifications of JECFA
• reg. compliance: EU Regulation 1223/2009; FCC; FDA 21 CFR 172.515
• vapor density: 3.5 (vs air)
• vapor pressure: 47 mmHg ( 20 °C)
• Assay: ≥99%
• form: liquid
• autoignition temp.: 894 °F
• expl. lim.: 1.8 %, 37 °F; 8 %
• refractive index: n20/D 1.377 (lit.)
• bp: 85-91 °C (lit.)
• mp: −73 °C (lit.)
• density: 0.872 g/mL at 25 °C (lit.)
• application(s): flavors and fragrances
• Documentation: see Safety & Documentation for available documents
• food allergen: no known allergens
• fragrance allergen: no known allergens
• Organoleptic: banana; ethereal; fruity; sweet
• SMILES string: CC(C)OC(C)=O
• InChI: 1S/C5H10O2/c1-4(2)7-5(3)6/h4H,1-3H3
• InChI key: JMMWKPVZQRWMSS-UHFFFAOYSA-N

Description

Application

• Comparative Study on the H-Abstraction Reactions of Isopropyl Acetate and Propyl Acetate by HO(2) and OH Radicals.: This research explores the reactivity of isopropyl acetate with radicals, crucial for understanding its stability and degradation in atmospheric conditions, offering insights relevant to environmental chemistry (Gao et al., 2024).


• Diastereoselective and Scalable Synthesis of 6-(S)-Hydroxycannabidivarin.: This study includes methods where isopropyl acetate is used in the synthesis of cannabinoids, demonstrating its utility in enhancing reaction conditions for pharmaceutical applications (Stone et al., 2023).


• Volatile Dual-Solvent Assisted Intermediate Phase Regulation for Anti-Solvent-Free Perovskite Photovoltaics.: Discusses the use of isopropyl acetate in producing advanced materials for solar cells, emphasizing its role in optimizing fabrication processes and enhancing the efficiency of renewable energy technologies (Yang et al., 2023).

Disclaimer

For R&D or non-EU Food use. Not for retail sale.

Safety Information

• Pictograms: GHS02,GHS07
• Signal Word: Danger
• Hazard Statements: H225,H319,H336
• Precautionary Statements: P210 - P233 - P240 - P241 - P242 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Flam. Liq. 2 - STOT SE 3
• Target Organs: Central nervous system
• Supplementary Hazards: EUH066
• Storage Class Code: 3 - Flammable liquids
• WGK: WGK 1
• Flash Point(F): 41.0 °F - closed cup
• Flash Point(C): 5 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves