Methyl 4-cyano-5-methylthiophene-2-carboxylate

Base Information

• Chemical Name: Methyl 4-cyano-5-methylthiophene-2-carboxylate
• CAS No.: 237385-16-9
• Molecular Formula: C₈H₇NO₂S
• Molecular Weight: 181.215
• DSSTox Substance ID: DTXSID401249003

Synonyms:237385-16-9;methyl 4-cyano-5-methylthiophene-2-carboxylate;SCHEMBL6925081;DTXSID401249003;DB-221140;Methyl 4-cyano-5-methyl-2-thiophenecarboxylate

Chemical Property of Methyl 4-cyano-5-methylthiophene-2-carboxylate

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 181.01974964
• Heavy Atom Count: 12
• Complexity: 233

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MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C=C(S1)C(=O)OC)C#N

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