structure of 2445-78-5

2-Methylbutyl 2-methylbutyrate(CAS 2445-78-5)

CAS No.: 2445-78-5 Brand: MolBest
M. Ft.: C10H20O2 Cat. No: G9749164
M. Wt.: 172.26 MDL: MFCD00059395
Storage: Store in a cool,dry area. Use: For laboratory research use only
HS CODE: 2915900090
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RG 2.5KG In Stock 1019 USD
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Applications of 2445-78-5

The primary applications of 2-methylbutyl 2-methylbutyrate include:

  • Flavoring agent: It is used in the food industry to impart fruity flavors to various products.
  • Fragrance ingredient: The compound is utilized in perfumery and cosmetic formulations due to its pleasant aroma.
  • Solvent: Its oily nature makes it useful as a solvent in certain industrial applications.
Similar Compounds

Several compounds share structural similarities with 2-methylbutyl 2-methylbutyrate:

  • Ethyl 2-methylbutyrate: A smaller ester with a similar branched acyl group.
  • Isoamyl acetate: Another branched ester with a fruity odor, commonly known as banana oil.
  • Butyl acetate: A straight-chain ester used in flavors and as a solvent.
  • 2-Methylbutyl butyrate: An ester with the same alkyl group but a non-branched acyl portion.
  • Pentyl butyrate: A straight-chain ester with the same number of carbon atoms.

These compounds differ in their exact structure, which affects their physical properties, odor characteristics, and potential applications. 2-Methylbutyl 2-methylbutyrate is unique due to its specific branching pattern, which contributes to its particular organoleptic properties and chemical behavior.

Physical and chemical properties of 2445-78-5

Boiling Point

70.00 to 72.00 °C. @ 11.00 mm Hg

Density

0.854-0.864

Exact Mass

172.146332

Flash Point

67.2±0.0 °C

H Bond Acceptors

1

H Bond Donors

0

Index of Refraction

1.409-1.509

LogP

3.530 (est)

Molecular Formula

C10H20O2

Molecular Weight

172.265

PSA

26.30000

Solubility

44.59 mg/L @ 25 °C (est)

Vapour Pressure

0.7±0.4 mmHg at 25°C

Spectrums of 2445-78-5

Attention:
1.The NMR spectrum displayed on the page is a pre-sale reference spectrum and may differ from that of the actual received batch.
2.The accompanying documentation will include the NMR spectrum and purity analysis data for the shipped batch.
Physical sample testing spectrum (NMR) of 2445-78-5

Retrosynthesis analysis of 2445-78-5


Q&A for CAS 2445-78-5

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Download SDS of 2445-78-5

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Signal Word

No hazard Signal Word applicable

Hazard Statements

H411 Toxic to aquatic life with long lasting effects

Safety Data Sheet

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