Methyl 5-Methyl-2-hexenoate | CAS No. 75513-56-3

Methyl 5-Methyl-2-hexenoate

Basic Information

CAS Number

75513-56-3

Molecular Formula

C8H14O2

Molecular Weight

142.2 g/mol

AD

Basic Physical Properties

Boiling Point

95-100°C 26mm

Flash Point

57°C

Refractive Index

1.4363

CC(C)CC=CC(=O)OC

InChI

InChI=1S/C8H14O2/c1-7(2)5-4-6-8(9)10-3/h4,6-7H,5H2,1-3H3/b6-4+

InChIKey

KNSMNULJDOTFMN-GQCTYLIASA-N

LogP

1.7616999999999998

Topological Polar Surface Area

26.3 Ų

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

125

Safety Information

View Safety Information

Hazard Statement

Hazard Class

Class 3 Class 3

Synonyms & References

English

  • 68797-67-1
  • MFCD00137613
  • NS00036694
  • 2-Hexenoic acid, 5-methyl-, methyl ester
  • (E)-5-Methyl-hex-2-enoic acid methyl ester
  • 5-Methyl-2-hex-2-enoic Acid Methyl Ester
  • AKOS006228985
  • SCHEMBL14552889
  • EINECS 272-308-5
  • A838440
  • (E)-Methyl 5-methyl-2-hexenoate
  • methyl (E)-5-methylhex-2-enoate
  • 75513-56-3
  • AS-54971
  • Methyl 5-methylhex-2-enoate
  • DTXSID5071751
  • (E)-Methyl5-methyl-2-hexenoate
  • Methyl 5-methyl-2-hexenoate
  • W11675
  • (E)-methyl 5-methylhex-2-enoate
  • 5-Methyl-2-hexenoic acid methyl ester

MDL Number

MFCD00137613

FAQ

What regulatory guidelines apply to Methyl 5-Methyl-2-hexenoate (CAS: 75513-56-3)?

Methyl 5-Methyl-2-hexenoate (CAS: 75513-56-3) falls under various regulatory frameworks. For industrial use, it must comply with REACH regulations and is subject to evaluation for its potential environmental and health impacts. In the United States, it is regulated by the EPA and the FDA, particularly for its use in food additives and cosmetics. Additionally, it should adhere to GHS classification for proper labeling and handling in the workplace.

Are there alternatives to Methyl 5-Methyl-2-hexenoate (CAS: 75513-56-3) in synthesis?

There are several alternatives to Methyl 5-Methyl-2-hexenoate (CAS: 75513-56-3) in synthesis, including its isomers and analogs such as methyl 5-ethyl-2-hexenoate. Common alternative reagents include methyl 2-methyl-3-hexenoate and methyl 3-methyl-2-pentenoate. These can serve similar functions in organic synthesis, offering flexibility in reaction conditions and product outcomes.

What is the market or research trend for Methyl 5-Methyl-2-hexenoate (CAS: 75513-56-3)?

The market for Methyl 5-Methyl-2-hexenoate (CAS: 75513-56-3) is growing due to its use in fragrance and flavor applications. Research trends are focusing on its potential use in natural product synthesis and as a precursor in other chemical processes. Market demand is also influenced by price fluctuations and the development of more sustainable and eco-friendly alternatives.

How should waste containing Methyl 5-Methyl-2-hexenoate (CAS: 75513-56-3) be handled?

Waste containing Methyl 5-Methyl-2-hexenoate (CAS: 75513-56-3) should be collected in appropriate containers and treated as hazardous waste. Proper incineration or professional waste disposal services should be utilized. Environmental precautions include minimizing exposure to air, water, and soil. Follow local regulations and guidelines for the safe disposal of chemical waste to prevent contamination and protect the environment.

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