9H-beta-Carboline

Basic Information

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CAS Number

244-63-3

Molecular Formula

C11H8N2

Molecular Weight

168.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

200.0 to 203.0 deg-C

Boiling Point

287.13°C (rough estimate)

Flash Point

182.1 °C

Refractive Index

1.5200 (estimate)

SMILES

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C1=CC=C2C(=C1)C3=C(N2)C=NC=C3

InChI

InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7,13H

InChIKey

AIFRHYZBTHREPW-UHFFFAOYSA-N

LogP

2.7161

Topological Polar Surface Area

28.68 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

193

Synonyms & References

English

MLS000069651
(c)micro-Carboline; 2-Azacarbazole
SR-01000000213-4
Spectrum2_000588
NCGC00018245-05
DTXCID201070
9H-Pyrido(3,4-B)indole
NCGC00018245-03
N-8720
KBio2_001612
HMS3369E13
Kinome_3628
CCRIS 6915
GTPL8222
BRD-K47467075-001-13-4
Carbazoline
HY-W008566
Norharmane (9H-pyrido(3,4-b)indole
NCIOpen2_001217
KBioGR_002537
9H-Pyrido[3,4-B]indole
244-66-6
BSPBio_002322
BDBM50013811
P1121
Tox21_200083
Q414226
KBio2_004180
94HMA1I78O
CHEMBL275224
Norharmane, 98%

MDL Number

MFCD00004956

Customs Code

2933990090

FAQ

What are the physical and chemical properties of 9H-beta-Carboline (CAS: 244-63-3)?

9H-beta-Carboline is a crystalline compound with a molecular weight of approximately 179.17 g/mol. It is slightly soluble in water but soluble in organic solvents like ethanol and acetone. Chemically, it is stable under normal conditions but can react with strong oxidizing agents. It is used in various applications due to its unique chemical properties.

How is 9H-beta-Carboline (CAS: 244-63-3) typically synthesized?

9H-beta-Carboline is commonly synthesized via functionalization of beta-carbolines using methods such as the Wittig reaction or Hofmann degradation. These reactions typically require specific catalysts and solvents. The yield and selectivity can vary based on the specific synthetic pathway chosen.

What industries use 9H-beta-Carboline (CAS: 244-63-3)?

9H-beta-Carboline is used in the pharmaceutical industry for its potential as a bioactive compound, in the polymer industry for its fluorescent and luminescent properties, and in the sensor industry due to its electronic properties. It is also explored in the semiconductor industry for its potential applications in organic electronics.

What precautions should be taken when handling 9H-beta-Carboline (CAS: 244-63-3)?

When handling 9H-beta-Carboline, it is essential to use appropriate personal protective equipment (PPE) including gloves, goggles, and lab coats. Handle in a well-ventilated area or fume hood. Store the compound away from heat and light. In the event of a spill, follow the safety data sheet (SDS) guidelines for proper disposal and clean-up.