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HomeProduct name list2-Methylindole-3-carboxaldehyde

2-Methylindole-3-carboxaldehyde

Synonym(s):3-Formyl-2-methylindole;NSC 11895

  • CAS NO.:5416-80-8
  • Empirical Formula: C10H9NO
  • Molecular Weight: 159.18
  • MDL number: MFCD00012077
  • EINECS: 226-512-6
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2023-06-08 17:06:37
2-Methylindole-3-carboxaldehyde Structural

What is 2-Methylindole-3-carboxaldehyde?

Chemical properties

Brown powder

The Uses of 2-Methylindole-3-carboxaldehyde

Reactant for preparation of:• ;Tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulators1• ;Fluorescent sensors (BODIPY)2• ;Antimicrobial agents against methicillin-resistant Staphylococcus aureus3• ;G protein-coupled receptor CRTh2 antagonists4• ;Inhibitors of PI3 kinase-α5• ;Antitubercular agents6• ;Anti-inflammatory agents7• ;Mycobacterium tuberculosis protein tyrosine phosphatase B8• ;Glucocorticoid receptor ligands9• ;Agents stimulating neurite outgrowth10

The Uses of 2-Methylindole-3-carboxaldehyde

Reactant for preparation of:

  • Tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulators
  • Fluorescent sensors (BODIPY)
  • Antimicrobial agents against methicillin-resistant Staphylococcus aureus
  • G protein-coupled receptor CRTh2 antagonists
  • Inhibitors of PI3 kinase-α
  • Antitubercular agents
  • Anti-inflammatory agents
  • Mycobacterium tuberculosis protein tyrosine phosphatase B
  • Glucocorticoid receptor ligands
  • Agents stimulating neurite outgrowth

Synthesis Reference(s)

Chemical and Pharmaceutical Bulletin, 31, p. 2892, 1983 DOI: 10.1248/cpb.31.2892

General Description

Oxidative activation of 2-methylindole-3-carboxaldehyde via N-heterocyclic carbene organocatalysis generates heterocyclic ortho-quinodimethane as a key intermediate.

Properties of 2-Methylindole-3-carboxaldehyde

Melting point: 200-201 °C (lit.)
Boiling point: 344.3±22.0 °C(Predicted)
Density  1.226±0.06 g/cm3(Predicted)
storage temp.  Keep in dark place,Sealed in dry,Room Temperature
solubility  soluble in Methanol
form  Powder
pka 16.08±0.30(Predicted)
color  Brown
CAS DataBase Reference 5416-80-8(CAS DataBase Reference)
EPA Substance Registry System 1H-Indole-3-carboxaldehyde, 2-methyl- (5416-80-8)

Safety information for 2-Methylindole-3-carboxaldehyde

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

Computed Descriptors for 2-Methylindole-3-carboxaldehyde

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