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Isobutyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate

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Identification
Molecular formula
C14H19NO4
CAS number
69987-74-2
IUPAC name
isobutyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate
State
State

At room temperature, isobutyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate exists typically as a solid. It is not volatile and can be handled as a standard organic solid in lab environments.

Melting point (Celsius)
85.00
Melting point (Kelvin)
358.15
Boiling point (Celsius)
378.00
Boiling point (Kelvin)
651.15
General information
Molecular weight
263.31g/mol
Molar mass
263.3060g/mol
Density
1.2500g/cm3
Appearence

This compound typically appears as a crystalline solid, similar in form to many organic esters. It may be colorless or have a pale hue depending on purity and method of preparation. The crystals can feature a glossy surface and may appear translucent when held against the light.

Comment on solubility

Solubility of Isobutyl 4,6-Dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate

The solubility of isobutyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate is influenced by several key factors, including its structure and the presence of hydroxyl groups. Understanding its solubility is essential for applications in pharmacology and organic synthesis.

Factors Affecting Solubility

  • Polarity: The presence of hydroxyl groups introduces polar characteristics, which generally increases solubility in polar solvents such as water.
  • Hydrogen Bonding: The ability of the hydroxyl groups to form hydrogen bonds enhances its solubility in polar solvents.
  • Alkyl Chain Influence: The isobutyl group contributes hydrophobic properties, which may decrease solubility in highly polar environments.

In summary, while the compound exhibits a degree of solubility due to its polar functional groups, the overall solubility will be moderated by the hydrophobic isobutyl component. For practical uses, testing in various solvents is recommended to determine the optimal conditions for solubility.

Interesting facts

Interesting Facts about Isobutyl 4,6-Dihydroxy-1,2,3,4-Tetrahydroisoquinoline-1-Carboxylate

Isobutyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate (commonly known as ITHC) is a fascinating compound that belongs to the family of isoquinolines. Here are some engaging aspects of this unique chemical:

  • Versatile Applications: ITHC has potential applications in medicinal chemistry, particularly due to its biological properties. Compounds of the isoquinoline family are known for their diverse pharmacological activities, including analgesic and antitumor effects.
  • Structural Significance: With multiple hydroxyl groups and a tetrahydroisoquinoline structure, ITHC exhibits intriguing stereochemistry, which plays a crucial role in its reactivity and interaction with biological targets.
  • Natural Occurrence: Isoquinoline derivatives are often found in various plants and serve as a source for natural products, which can inspire synthetic modifications leading to novel therapeutic agents.
  • Research Potential: Ongoing research on ITHC may uncover its mechanism of action and efficacy in treating specific diseases, showcasing the compound’s significance in drug discovery.

As renowned chemist Linus Pauling once said, "The best way to have a good idea is to have a lot of ideas." The continued exploration of compounds like isobutyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate could lead to groundbreaking discoveries in therapeutic applications.

In summary, ITHC not only exemplifies the beauty of structural diversity in organic compounds but also represents the exciting potential that lies within the realm of natural product chemistry.

Synonyms
23824-33-1
1-ISOQUINOLINECARBOXYLIC ACID, 1,2,3,4-TETRAHYDRO-4,6-DIHYDROXY-, ISOBUTYL ESTER
RefChem:1055671
4,6-Dihydroxy-1,2,3,4-tetrahydro-1-isoquinolinecarboxylic acid isobutyl ester
BRN 0489051
2-methylpropyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate
1-Isoquinolinecarboxylic acid, 4,6-dihydroxy-1,2,3,4-tetrahydro-, isobutyl ester
DTXSID90946625