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cocaine

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Identification
Molecular formula
C17H21NO4
CAS number
50-36-2
IUPAC name
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 1H-indole-3-carboxylate
State
State

At room temperature, cocaine is generally in a solid state, appearing as a powder. It is often handled as a crystalline powder which is derived from leaves of the coca plant.

Melting point (Celsius)
98.00
Melting point (Kelvin)
371.15
Boiling point (Celsius)
187.00
Boiling point (Kelvin)
460.15
General information
Molecular weight
339.81g/mol
Molar mass
339.8140g/mol
Density
1.1000g/cm3
Appearence

Cocaine typically appears as a white crystalline powder or as colorless crystals. It has a pearly shine and may sometimes have a slight odor of methyl benzoate or benzoic acid due to residual chemicals from its processing.

Comment on solubility

Solubility of (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 1H-indole-3-carboxylate

The solubility of the compound (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 1H-indole-3-carboxylate, with the chemical formula C17H21NO4, can be influenced by several factors. Understanding its solubility characteristics is crucial for its application in various fields of chemistry and pharmacology.

Factors Affecting Solubility

The solubility of this compound is likely affected by the following factors:

  • Polarity: The presence of polar functional groups such as carboxylate may enhance solubility in polar solvents.
  • Hydrogen Bonding: The ability to form hydrogen bonds can significantly influence how well the compound dissolves in solvents like water.
  • Molecular Size: The larger molecular structure may affect diffusion and solvation energies.
  • Temperature: Increased temperature can generally improve solubility, offering a solvation advantage for this polyfunctional compound.

Expected Solubility Behavior

Based on its structural configuration and functional groups, one might expect:

  • A moderate solubility in polar organic solvents such as methanol or ethanol.
  • Potentially higher challenges to dissolve in pure water due to its complex bicyclic structure.
  • Solubility impacts on bioavailability in pharmaceutical applications, making it essential to assess in physiological conditions.

In summary, while insights can be drawn about the solubility of (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 1H-indole-3-carboxylate, specific experimental data is necessary to determine the precise behavior of this compound in various solvents.

Interesting facts

Interesting Facts about (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 1H-indole-3-carboxylate

(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 1H-indole-3-carboxylate is a fascinating compound that demonstrates the complexity and beauty of chemical structures within organic chemistry. Here are some intriguing aspects of this compound:

  • Unique Structure: This compound features a bicyclic structure, which is notable for its two interconnected rings. This specific arrangement can impart unique chemical properties and reactivity patterns.
  • Applications: Compounds of this class have potential applications in the pharmaceutical industry, especially for drug development. Their structural characteristics may influence their interactions with biological targets.
  • Biological Relevance: The indole moiety is commonly found in many biologically active molecules, including neurotransmitters and hormones. This suggests that the compound might exhibit interesting biological activity.
  • Synthetic Pathways: The synthesis of such compounds often involves multiple reaction steps, showcasing the creativity of synthetic chemists. These pathways may involve techniques like cyclization and functional group transformations.
  • Research Potential: There is ongoing research into the modifications of similar indole derivatives to enhance their biological activity or selectivity, highlighting the significance of chemical diversity in drug design.

In conclusion, (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 1H-indole-3-carboxylate exemplifies how a single compound can encapsulate a wealth of chemical knowledge and potential, making it a subject of interest for both students and advanced researchers in the field of chemistry.

Synonyms
8-methyl-8-azabicyclo[3.2.1]oct-3-yl 1H-indole-3-carboxylate
CHEMBL8197
89565-68-4
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 1H-indole-3-carboxylate
8-METHYL-8-AZABICYCLO[3.2.1]OCTAN-3-YL 1H-INDOLE-3-CARBOXYLATE
124583-47-7
NCGC00015984-03
Enamine_001310
ICS 205-930
Biomol-NT_000158
Lopac0_001253
Oprea1_462281
Oprea1_655173
REGID_for_CID_5595
MLS000055682
SCHEMBL463128
BPBio1_000618
SCHEMBL8946882
CHEBI:91913
DTXSID00861113
ZNRGQMMCGHDTEI-UHFFFAOYSA-N
BCPP000032
HMS1397L12
HMS2494I19
BCP27620
Tox21 110272
BBL033991
BDBM50007871
STL257062
AKOS000573788
AKOS022111472
CCG-205327
SDCCGSBI-0051220.P002
NCGC00015984-02
NCGC00015984-05
NCGC00015984-10
NCGC00162379-01
NCGC00162379-02
SMR000060690
AB00420704_13
EN300-6743259
AH-034/34967008
L000605
BRD-A83859836-001-01-4
BRD-A83859836-003-02-8
Q27163713
Z56794743
1H-indole-3-carboxylic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester
SDZ-ICS-930;ICS-205930; ICS 205930; ICS205930; ICS 205-930; ICS-205-930