5-Methoxy-1H-indole-2-carbaldehyde

Base Information

• Chemical Name: 5-Methoxy-1H-indole-2-carbaldehyde
• CAS No.: 21778-81-4
• Molecular Formula: C10H9NO2
• Molecular Weight: 175.187
• Hs Code.: 2933990090
• European Community (EC) Number: 864-816-6
• DSSTox Substance ID: DTXSID50356584
• Nikkaji Number: J2.798.239E
• Wikidata: Q82136008
• Mol file: 21778-81-4.mol

Synonyms:5-Methoxy-1H-indole-2-carbaldehyde;21778-81-4;1H-Indole-2-carboxaldehyde, 5-methoxy-;5-methoxyindole-2-carbaldehyde;5-methoxy-1H-Indole-2-carboxaldehyde;5-Methoxyindole-2-carboxaldehyde;MFCD00297147;AC1LGSZY;Oprea1_201769;Oprea1_372028;SCHEMBL92643;DTXSID50356584;IEHXXJMABHGXCG-UHFFFAOYSA-N;5-methoxy-1H-indole-2-carbaldehyd;AMY17238;WAA77881;STL322169;AKOS000301780;AS-53399;SY238419;BB 0220028;CS-0150273;FT-0677451;EN300-312706;P16431;5-Methoxy-1H-indole-2-carbaldehyde, AldrichCPR;J-014283;Z1198153197

Chemical Property of 5-Methoxy-1H-indole-2-carbaldehyde

Chemical Property:

• Melting Point: 140-141 °C
• Boiling Point: 375.2±22.0 °C(Predicted)
• PKA: 14.76±0.30(Predicted)
• PSA: 42.09000
• Density: 1.273±0.06 g/cm3(Predicted)
• LogP: 1.98900
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 175.063328530
• Heavy Atom Count: 13
• Complexity: 195

Purity/Quality:

98%min ^*data from raw suppliers

5-Methoxy-1H-indole-2-carbaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC2=C(C=C1)NC(=C2)C=O