methyl 5-formyl-1-methyl-1H-pyrrole-3-carboxylate

Base Information

• Chemical Name: methyl 5-formyl-1-methyl-1H-pyrrole-3-carboxylate
• CAS No.: 119580-82-4
• Molecular Formula: C₈H₉NO₃
• Molecular Weight: 167.164
• DSSTox Substance ID: DTXSID101179489
• Nikkaji Number: J1.551.470A

Synonyms:119580-82-4;methyl 5-formyl-1-methyl-1H-pyrrole-3-carboxylate;methyl 5-formyl-1-methylpyrrole-3-carboxylate;SCHEMBL2405805;KZWOJEVANUUKNM-UHFFFAOYSA-N;DTXSID101179489;1H-Pyrrole-3-carboxylic acid, 5-formyl-1-methyl-, methyl ester;EN300-673336;G74409;methyl5-formyl-1-methyl-1H-pyrrole-3-carboxylate;Z1255446579

Chemical Property of methyl 5-formyl-1-methyl-1H-pyrrole-3-carboxylate

Chemical Property:

• XLogP3: 0.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 167.058243149
• Heavy Atom Count: 12
• Complexity: 193

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MSDS Files:

Useful:

• Canonical SMILES: CN1C=C(C=C1C=O)C(=O)OC

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