Methyl 1-methoxy-1H-indole-3-carboxylate

Base Information

• Chemical Name: Methyl 1-methoxy-1H-indole-3-carboxylate
• CAS No.: 18377-50-9
• Molecular Formula: C₁₁H₁₁NO₃
• Molecular Weight: 205.213
• UNII: 8A5KL75GTD
• DSSTox Substance ID: DTXSID601275200
• Nikkaji Number: J1.053.198E
• Wikidata: Q105123643
• Metabolomics Workbench ID: 45726
• ChEMBL ID: CHEMBL318151
• Mol file: 18377-50-9.mol

Synonyms:Methyl 1-methoxyindole-3-carboxylate;Methyl 1-methoxy-1H-indole-3-carboxylate;18377-50-9;Phytoalexine;8A5KL75GTD;CHEMBL318151;SCHEMBL1849453;CHEBI:179420;DTXSID601275200;Indole-3-carboxylic acid, 1-methoxy-, methyl ester;1H-Indole-3-carboxylic acid, 1-methoxy-, methyl ester

Chemical Property of Methyl 1-methoxy-1H-indole-3-carboxylate

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 205.07389321
• Heavy Atom Count: 15
• Complexity: 244

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=CN(C2=CC=CC=C21)OC

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