methyl 3-[5-cyano-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl]-2-thiophenecarboxylate

Base Information

• Chemical Name: methyl 3-[5-cyano-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl]-2-thiophenecarboxylate
• CAS No.: 446276-11-5
• Molecular Formula: C11H7N3O4S
• Molecular Weight: 277.26
• Mol file: 446276-11-5.mol

Synonyms:methyl 3-[5-cyano-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl]-2-thiophenecarboxylate;446276-11-5;methyl 3-(5-cyano-2,4-dioxopyrimidin-1-yl)thiophene-2-carboxylate;MFCD00172924;AKOS005069424;CCG-250981;CS-0365698;11E-961;Methyl 3-(5-cyano-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)thiophene-2-carboxylate;methyl3-[5-cyano-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl]-2-thiophenecarboxylate

Chemical Property of methyl 3-[5-cyano-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl]-2-thiophenecarboxylate

Chemical Property:

• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 277.01572689
• Heavy Atom Count: 19
• Complexity: 521

Purity/Quality:

98%min ^*data from raw suppliers

Methyl 3-[5-cyano-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl]-2-thiophenecarboxylate >95% ^*data from reagent suppliers

Safty Information:

• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

Useful:

• Canonical SMILES: COC(=O)C1=C(C=CS1)N2C=C(C(=O)NC2=O)C#N

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