8.18701

Benzyl benzoate

for synthesis

• Sinônimo(s): Benzyl benzoate, Benzoic acid benzyl ester
• Fórmula empírica (Notação de Hill): C₁₄H₁₂O₂
• Número CAS: 120-51-4
• Peso molecular: 212.24
• Número MDL: MFCD00003075
• Código UNSPSC: 12352108
• Número do índice EC: 204-402-9
• NACRES: NA.22

Propriedades

• pressão de vapor: <0.1 hPa ( 25 °C)
• Nível de qualidade: 200
• Ensaio: ≥98.0% (GC)
• Formulário: liquid
• temperatura de autoignição: 480 °C
• potência: 1904 mg/kg LD₅₀, oral (Rat); 4000 mg/kg LD₅₀, skin (Rabbit)
• p.e.: 324 °C/1013 hPa
• pf: 21 °C
• temperatura de transição: flash point 158 °C
• solubilidade: 0.0153 g/L
• densidade: 1.12 g/cm³ at 20 °C
• temperatura de armazenamento: 2-30°C
• cadeia de caracteres SMILES: O(Cc2ccccc2)C(=O)c1ccccc1
• InChI: 1S/C14H12O2/c15-14(13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1-10H,11H2
• chave InChI: SESFRYSPDFLNCH-UHFFFAOYSA-N

Descrição

Aplicação

• Essential oil therapy for inflammation: Research highlights the use of Cinnamomum zeylanicum essential oil, containing benzyl benzoate, in treating inflammation. Network pharmacology and experimental verification delineated the multitarget pharmacological mechanism, underscoring its potential as an anti-inflammatory agent (Mohanty et al., 2024).
• Pest control in agriculture: Benzyl benzoate was evaluated for its effectiveness as an eco-friendly pesticide against the red flour beetle, Tribolium castaneum, demonstrating significant repellency and low toxicity, making it a viable option for sustainable pest management (Aboelhadid et al., 2023).
• Scabies treatment: A comparative study on the efficacy of topical benzyl benzoate versus oral ivermectin for treating scabies revealed that benzyl benzoate is an effective topical treatment, providing a viable option for scabies management (Meyersburg et al., 2023).

Nota de análise

Assay (GC, area%): ≥ 98.0 % (a/a)
Density (d 20 °C/ 4 °C): 1.117 - 1.119
Identity (IR): passes test
Due to its specific melting range the product may be solid, liquid, a solidified melt or a supercooled melt.

Informações de segurança

• Pictogramas: GHS07,GHS09
• Palavra indicadora: Warning
• Frases de perigo: H302 - H410
• Declarações de precaução: P264 - P270 - P273 - P301 + P312 - P391 - P501
• Classificações de perigo: Acute Tox. 4 Oral - Aquatic Acute 1 - Aquatic Chronic 2
• Código de classe de armazenamento: 10 - Combustible liquids
• Classe de risco de água (WGK): WGK 2
• Ponto de fulgor (°F): 298.4 °F - closed cup
• Ponto de fulgor (°C): 148 °C - closed cup