5-methoxy-1-methyl-1H-indole-3-carbaldehyde

Base Information

• Chemical Name: 5-methoxy-1-methyl-1H-indole-3-carbaldehyde
• CAS No.: 39974-94-2
• Molecular Formula: C11H11 N O2
• Molecular Weight: 189.214
• Hs Code.: 2933990090
• European Community (EC) Number: 670-298-0
• DSSTox Substance ID: DTXSID40358951
• Nikkaji Number: J2.217.203D
• Wikidata: Q82139894
• ChEMBL ID: CHEMBL1650261
• Mol file: 39974-94-2.mol

Synonyms:5-methoxy-1-methyl-1H-indole-3-carbaldehyde;39974-94-2;5-methoxy-1-methylindole-3-carbaldehyde;5-Methoxy-1-Methylindole-3-Carboxaldehyde;5-methoxy-1-methyl-1H-Indole-3-carboxaldehyde;MFCD01578324;1H-Indole-3-carboxaldehyde, 5-methoxy-1-methyl-;3-Formyl-5-methoxy-1-methylindole;SCHEMBL1093582;CHEMBL1650261;DTXSID40358951;OFNAEHQJIMREFJ-UHFFFAOYSA-N;5-methoxy-1-methylindole-3-aldehyde;STK012175;AKOS000265484;A6673;CS-0042966;FT-0620549;EN300-330402;F52626;8Z-0841;J-517669;5-Methoxy-1-methylindole-3-carboxaldehyde, AldrichCPR;Z57205017

Chemical Property of 5-methoxy-1-methyl-1H-indole-3-carbaldehyde

Chemical Property:

• Vapor Pressure: 2.65E-05mmHg at 25°C
• Melting Point: 133-136°C
• Refractive Index: 1.565
• Boiling Point: 357.9°Cat760mmHg
• Flash Point: 170.2°C
• PSA: 31.23000
• Density: 1.14g/cm³
• LogP: 1.99940
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Sensitive.: Air Sensitive
• Water Solubility.: It is insoluble in water.
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 189.078978594
• Heavy Atom Count: 14
• Complexity: 219

Purity/Quality:

98%,99%, ^*data from raw suppliers

5-Methoxy-1-methyl-1H-indole-3-carbaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R36/37/38:Irritating to eyes, respiratory system and skin.
• Hazard Codes: Xn
• Statements: 36/37/38-22
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C=C(C2=C1C=CC(=C2)OC)C=O
• Uses: 5-Methoxy-1-methylindole-3-carboxaldehyde is used as an important raw material and intermediate used in organic Synthesis, pharmaceuticals, agrochemicals and dyestuff.