Skip to main content

Isopropyl cyanoacetate

ADVERTISEMENT
Identification
Molecular formula
C6H9NO2
CAS number
40156-74-5
IUPAC name
isopropyl 2-cyanoacetate
State
State

Isopropyl cyanoacetate is typically found in a liquid state at room temperature.

Melting point (Celsius)
-76.00
Melting point (Kelvin)
197.15
Boiling point (Celsius)
179.00
Boiling point (Kelvin)
452.15
General information
Molecular weight
127.13g/mol
Molar mass
127.1330g/mol
Density
0.9921g/cm3
Appearence

Isopropyl cyanoacetate is a colorless liquid. It's an organic compound with a fruity odor, often used in fragrance applications and organic synthesis.

Comment on solubility

Solubility of Isopropyl 2-cyanoacetate

Isopropyl 2-cyanoacetate, with the chemical formula C6H9N O2, exhibits interesting solubility characteristics that are important for its applications in various chemical syntheses. Generally speaking, the solubility of this compound can be outlined as follows:

  • Solvent Compatibility: Isopropyl 2-cyanoacetate is soluble in a variety of organic solvents, such as:
    • Ethyl acetate
    • Acetone
    • Chloroform
    • Dimethyl sulfoxide (DMSO)
  • Water Solubility: It has low solubility in water, which limits its use in aqueous environments.
  • Influencing Factors: The solubility is affected by:
    • Temperature: Higher temperatures often increase solubility in organic solvents.
    • pH Levels: The ionization state can also play a significant role in determining solubility.

Understanding these solubility properties is crucial when considering isopropyl 2-cyanoacetate for use in synthesizing other compounds or materials, as well as in reaction conditions where solubility influences reactivity and product formation.

Interesting facts

Interesting Facts about Isopropyl 2-Cyanoacetate

Isopropyl 2-cyanoacetate is a fascinating compound with various applications and significance in the field of organic chemistry. Here are some intriguing points:

  • Versatile Building Block: This compound serves as an important intermediate in the synthesis of various pharmaceuticals and agrochemicals. Its cyano group is particularly valuable in building complex molecular architectures.
  • Synthesis Opportunities: Isopropyl 2-cyanoacetate can be synthesized through straightforward methods, often involving simple reactions that make use of readily available starting materials. This accessibility promotes its use in research and industry.
  • Diverse Functionalities: The presence of both an isopropyl group and a cyanoacetate moiety allows for a range of reactivity. It can participate in various reactions, such as nucleophilic additions and cyclizations, which are crucial in the formation of more complex structures.
  • Potential Pharmacological Activity: Compounds containing similar structural motifs have been investigated for their biological activities. Thus, isopropyl 2-cyanoacetate holds potential for further exploration in medicinal chemistry.
  • Industrial Applications: Beyond pharmaceuticals, it may find applications in the development of new materials or as a solvent in chemical processes, demonstrating the broad applicability of cyanoacetates in diverse fields.

As scientific research continues to evolve, compounds like isopropyl 2-cyanoacetate remind us of the importance of exploring chemical diversity and pursuing innovative applications. The future may unveil even more fascinating aspects of this compound!

Synonyms
Isopropyl cyanoacetate
isopropyl 2-cyanoacetate
Cyanoacetic Acid Isopropyl Ester
ACETIC ACID, CYANO-, ISOPROPYL ESTER
0V3MGI9XMA
Acetic acid, cyano-, 1-methylethyl ester
NSC 1071
EINECS 236-421-3
BRN 1756014
NSC-1071
DTXSID20158198
ACETIC ACID, 2-CYANO-, 1-METHYLETHYL ESTER
DTXCID3080689
236-421-3
13361-30-3
propan-2-yl 2-cyanoacetate
ISOPROPYLCYANOACETATE
MFCD00019842
propan-2-yl cyanoacetate
sopropyl 2-cyanoacetate
UNII-0V3MGI9XMA
methylethyl 2-cyanoacetate
SCHEMBL1170737
SCHEMBL1421343
BESQLCCRQYTQQI-UHFFFAOYSA-
cyano-acetic acid isopropyl ester
NSC1071
Isopropyl cyanoacetate, >=98.0%
BBL009730
SBB056441
STL141095
AKOS000120774
CYANOACETIC ACID, ISOPROPYL ESTER
AS-13619
SY048383
DB-062982
NS00024297
EN300-20806
D97852
InChI=1/C6H9NO2/c1-5(2)9-6(8)3-4-7/h5H,3H2,1-2H3