Methyl 2-[(cyanoacetyl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate

Base Information

• Chemical Name: Methyl 2-[(cyanoacetyl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate
• CAS No.: 545437-55-6
• Molecular Formula: C16H14N2O3S
• Molecular Weight: 314.4
• DSSTox Substance ID: DTXSID501148442
• Mol file: 545437-55-6.mol

Synonyms:545437-55-6;methyl 2-[(cyanoacetyl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate;Methyl 2-[(2-cyanoacetyl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate;METHYL 2-[(CYANOACETYL)AMINO]-4-(4-METHYLPHENYL)-THIOPHENE-3-CARBOXYLATE;Oprea1_667335;DTXSID501148442;BBL016999;methyl 2-(2-cyanoacetamido)-4-(4-methylphenyl)thiophene-3-carboxylate;MFCD03391426;STK438777;AKOS003274392;VS-05759;Methyl2-(2-cyanoacetamido)-4-(p-tolyl)thiophene-3-carboxylate;Methyl 2-(2-cyanoacetamido)-4-(p-tolyl)thiophene-3-carboxylate;Methyl 2-[(2-cyanoacetyl)amino]-4-(4-methylphenyl)-3-thiophenecarboxylate

Chemical Property of Methyl 2-[(cyanoacetyl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate

Chemical Property:

• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 314.07251349
• Heavy Atom Count: 22
• Complexity: 465

Purity/Quality:

98%min ^*data from raw suppliers

Methyl 2-[(cyanoacetyl)amino]-4-(4-methylphenyl)-thiophene-3-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CC#N