6-(2,2-Dimethoxyethoxy)-1-oxo-1,2,3,4-tetrahydroisoquinoline

Base Information

• Chemical Name: 6-(2,2-Dimethoxyethoxy)-1-oxo-1,2,3,4-tetrahydroisoquinoline
• CAS No.: 147497-58-3
• Molecular Formula: C13H17NO4
• Molecular Weight: 251.282
• DSSTox Substance ID: DTXSID001236420
• Mol file: 147497-58-3.mol

Synonyms:SCHEMBL8542496;NMMLKJYTMCRGEX-UHFFFAOYSA-N;DTXSID001236420;6-(2,2-dimethoxyethoxy)-1-oxo-1,2,3,4-tetrahydroisoquinoline;147497-58-3;6-(2,2-Dimethoxyethoxy)-3,4-dihydro-1(2H)-isoquinolinone;6-(2,2-dimethoxyethoxy)- 1-oxo-1,2,3,4-tetrahydroisoquinoline;6-(2,2-dimethoxyethoxy)-1-oxo-1,2,3,4 -tetrahydroisoquinoline

Chemical Property of 6-(2,2-Dimethoxyethoxy)-1-oxo-1,2,3,4-tetrahydroisoquinoline

Chemical Property:

• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 251.11575802
• Heavy Atom Count: 18
• Complexity: 280

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MSDS Files:

Useful:

• Canonical SMILES: COC(COC1=CC2=C(C=C1)C(=O)NCC2)OC

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