1-(9H-beta-Carbolin-1-yl)ethanone

Basic Information

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CAS Number

50892-83-6

Molecular Formula

C13H10N2O

Molecular Weight

210.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Powder

Solubility

N/A

SMILES

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CC(=O)C1=NC=CC2=C1NC3=CC=CC=C23

InChI

InChI=1S/C13H10N2O/c1-8(16)12-13-10(6-7-14-12)9-4-2-3-5-11(9)15-13/h2-7,15H,1H3

InChIKey

NXZSUJKPVSDFNF-UHFFFAOYSA-N

LogP

2.9187000000000003

Topological Polar Surface Area

45.75 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

292

Safety Information

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Storage Conditions

2-8℃

Synonyms & References

English

MFCD18803841
D72789
DTXSID70348587
1-(9H-Pyrido[3,4-b]indol-1-yl)ethan-1-one
A-carboline
Q27137940
1-acetyl beta carboline
CHEBI:69598
1-Acetyl-
SCHEMBL4069498
CS-0046518
1-acetyl beta-carboline
InChI=1/C13H10N2O/c1-8(16)12-13-10(6-7-14-12)9-4-2-3-5-11(9)15-13/h2-7,15H,1H
1-Acetyl-??-carboline
1-(9H-beta-carbolin-1-yl)ethanone
ethanone, 1-(9H-pyrido[3,4-b]indol-1-yl)-
CHEMBL1682931
1-Acetyl-beta-carboline
AKOS030597436
FS-7524
50892-83-6
1-(9H-pyrido[3,4-b]indol-1-yl)ethanone
HY-W060074
Ethanone, 1-(9H-pyrido[3,4-b]indol-1-yl)-
1-(9H-β-carbolin-1-yl)-ethanone
1-ACETYL-B-CARBOLINE
1-Acetyl-β-carboline

MDL Number

MFCD18803841

Customs Code

2933990090

FAQ

What are the physical and chemical properties of 1-(9H-beta-Carbolin-1-yl)ethanone (CAS: 50892-83-6)?

1-(9H-beta-Carbolin-1-yl)ethanone has a white crystalline form and a molecular weight of approximately 198.22 g/mol. Its solubility is low in water but it is more soluble in organic solvents like ethanol and acetone. It is moderately reactive towards nucleophiles and can undergo substitution reactions. The compound is stable under normal storage conditions but may degrade under basic conditions.

How is 1-(9H-beta-Carbolin-1-yl)ethanone (CAS: 50892-83-6) typically synthesized?

1-(9H-beta-Carbolin-1-yl)ethanone can be synthesized via the condensation of 9H-beta-carbolin-1-ylamine with acetyl chloride. The reaction is catalyzed by anhydrous aluminum chloride and proceeds with high selectivity and yield. Common solvents for this reaction include dichloromethane or toluene.

What industries use 1-(9H-beta-Carbolin-1-yl)ethanone (CAS: 50892-83-6)?

1-(9H-beta-Carbolin-1-yl)ethanone is primarily used in the pharmaceutical industry for the synthesis of certain drugs. It is also applied in the sensor industry for developing chemical sensors due to its unique functional groups. Additionally, it can be used in the polymer industry for modifying polymer properties.

What precautions should be taken when handling 1-(9H-beta-Carbolin-1-yl)ethanone (CAS: 50892-83-6)?

When handling 1-(9H-beta-Carbolin-1-yl)ethanone, proper personal protective equipment (PPE) should be worn, including gloves and safety goggles. The compound should be stored in a cool, dry place away from heat sources. In case of spill, it should be carefully cleaned up using appropriate absorbent materials. Always refer to the Safety Data Sheet (SDS) for detailed safety information.