
CAS 18937-78-5
:Methyl 2-heptynoate
Description:
Methyl 2-heptynoate is an organic compound classified as an alkyne and an ester. It features a terminal alkyne functional group, which contributes to its reactivity and unique properties. The molecular formula of methyl 2-heptynoate is C9H16O2, indicating it contains nine carbon atoms, sixteen hydrogen atoms, and two oxygen atoms. This compound is typically a colorless to pale yellow liquid with a fruity odor, making it of interest in flavor and fragrance applications. Methyl 2-heptynoate is soluble in organic solvents such as ethanol and ether but has limited solubility in water due to its hydrophobic carbon chain. Its structure includes a methyl ester group, which enhances its volatility and reactivity in various chemical reactions, including nucleophilic additions and condensation reactions. Additionally, it can serve as a building block in organic synthesis, particularly in the preparation of more complex molecules. Safety precautions should be observed when handling this compound, as it may pose health risks if inhaled or ingested.
Formula:C8H12O2
InChI:InChI=1S/C8H12O2/c1-3-4-5-6-7-8(9)10-2/h3-5H2,1-2H3
InChI key:InChIKey=IATZLNCRIIUXJM-UHFFFAOYSA-N
SMILES:C(C#CCCCC)(OC)=O
Synonyms:- Methyl 2-heptynoate
- 2-Heptynoic acid, methyl ester
- NSC 129339
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