methyl 4-formyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylate

Base Information

• Chemical Name: methyl 4-formyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylate
• CAS No.: 1190312-00-5
• Molecular Formula: C10H8N2O3
• Molecular Weight: 204.18212
• DSSTox Substance ID: DTXSID801205942
• Mol file: 1190312-00-5.mol

Synonyms:1190312-00-5;methyl 4-formyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylate;4-FORMYL-7-AZAINDOLE-3-CARBOXYLIC ACID METHYL ESTER;DTXSID801205942;SB14459;methyl4-formyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylate

Chemical Property of methyl 4-formyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylate

Chemical Property:

• PKA: 11.14±0.40(Predicted)
• Density: 1.411±0.06 g/cm3(Predicted)
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 204.05349212
• Heavy Atom Count: 15
• Complexity: 269

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC(=O)C1=CNC2=NC=CC(=C12)C=O