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

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Identification
Molecular formula
C12H15NO4
CAS number
54889-00-2
IUPAC name
ethyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate
State
State

At room temperature, ethyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate is typically in a solid state.

Melting point (Celsius)
207.00
Melting point (Kelvin)
480.15
Boiling point (Celsius)
517.70
Boiling point (Kelvin)
790.90
General information
Molecular weight
237.26g/mol
Molar mass
237.2580g/mol
Density
1.2700g/cm3
Appearence

Ethyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate typically appears as an off-white to light yellow solid powder, crystallizing in a form that may vary based on purity.

Comment on solubility

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

The solubility of ethyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate is influenced by its unique chemical structure and functional groups. This compound features hydroxyl groups, which typically enhance solubility in polar solvents due to the ability to form hydrogen bonds.

Key Points about Solubility:

  • Polar Nature: The presence of hydroxyl groups makes the molecule polar, suggesting high solubility in polar solvents like water.
  • Hydrogen Bond Formation: The hydroxyl groups can engage in hydrogen bonding, further increasing solubility in suitable solvents.
  • Ethyl Group Influence: The ethyl ester group may provide some hydrophobic character, potentially decreasing solubility in highly polar solvents.
  • Solvent Choice: It is likely more soluble in alcohols or other organic solvents with moderate polarity.

In conclusion, while ethyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate shows promise for good solubility, the degree can vary significantly with different solvents. Testing in various environments is recommended to understand its solubility behavior comprehensively.

Interesting facts

Interesting Facts about Ethyl 4,6-Dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate

Ethyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate is a fascinating compound in the realm of organic chemistry. Here are some intriguing aspects of this compound:

  • Biologically Active Derivative: This compound is a derivative of isoquinoline, a structure known for its significant biological activities. It has shown potential in various pharmacological applications, making it a subject of interest in medicinal chemistry.
  • Pharmacological Importance: Isoquinoline derivatives, including this compound, have been studied for their possible effects in treating neurological disorders and have also been explored for their antioxidant properties.
  • Synthetic Pathways: The synthesis of this compound typically involves the manipulation of traditional organic reactions, yielding interesting challenges and opportunities for chemists to develop novel synthetic methodologies.
  • Natural Occurrence: Compounds similar to this one have been isolated from certain plants, implying its presence in natural products, contributing to the chemical diversity of herbal medicines.
  • Structure-Activity Relationship: The presence of hydroxyl groups in this compound plays a critical role in its reactivity and biological activity, making it a valuable subject for studying structure-activity relationships (SAR).

Overall, ethyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate showcases the intricate relationship between chemical structure and biological function, highlighting why researchers in medicinal chemistry continue to investigate its properties and potential applications.

Synonyms
23824-30-8
1-ISOQUINOLINECARBOXYLIC ACID, 1,2,3,4-TETRAHYDRO-4,6-DIHYDROXY-, ETHYL ESTER
RefChem:1055670
4,6-Dihydroxy-1,2,3,4-tetrahydro-1-isoquinolinecarboxylic acid ethyl ester
BRN 0486335
ethyl 4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate
1-Isoquinolinecarboxylic acid, 4,6-dihydroxy-1,2,3,4-tetrahydro-, ethyl ester
SCHEMBL5185322
DTXSID30946624