3-Methyl-4,5-dihydro-2H-benzo[e]isoindole-1-carboxylic acid ethyl ester

Base Information

• Chemical Name: 3-Methyl-4,5-dihydro-2H-benzo[e]isoindole-1-carboxylic acid ethyl ester
• CAS No.: 81979-59-1
• Molecular Formula: C₁₆H₁₇NO₂
• Molecular Weight: 255.316
• DSSTox Substance ID: DTXSID601186879
• Nikkaji Number: J2.152.175B

Synonyms:DTXSID601186879;Ethyl 4,5-dihydro-3-methyl-2H-benz[e]isoindole-1-carboxylate;3-Methyl-4,5-dihydro-2H-benzo[e]isoindole-1-carboxylic acid ethyl ester;81979-59-1

Chemical Property of 3-Methyl-4,5-dihydro-2H-benzo[e]isoindole-1-carboxylic acid ethyl ester

Chemical Property:

• XLogP3: 3.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 255.125928785
• Heavy Atom Count: 19
• Complexity: 344

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MSDS Files:

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• Canonical SMILES: CCOC(=O)C1=C2C(=C(N1)C)CCC3=CC=CC=C32

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