Ethyl 1-cyano-3,4-dihydroisoquinoline-2(1H)-carboxylate

Base Information

• Chemical Name: Ethyl 1-cyano-3,4-dihydroisoquinoline-2(1H)-carboxylate
• CAS No.: 27002-42-2
• Molecular Formula: C₁₃H₁₄N₂O₂
• Molecular Weight: 230.266
• DSSTox Substance ID: DTXSID90496074

Synonyms:27002-42-2;DTXSID90496074;Ethyl 1-cyano-3,4-dihydroisoquinoline-2(1H)-carboxylate

Chemical Property of Ethyl 1-cyano-3,4-dihydroisoquinoline-2(1H)-carboxylate

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 230.105527694
• Heavy Atom Count: 17
• Complexity: 334

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)N1CCC2=CC=CC=C2C1C#N

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