4-Methyl-2-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-5-carboxylic acid methyl ester

Base Information

• Chemical Name: 4-Methyl-2-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-5-carboxylic acid methyl ester
• CAS No.: 89647-48-3
• Molecular Formula: C12H14N2O3
• Molecular Weight: 234.25
• DSSTox Substance ID: DTXSID101008909

Synonyms:89647-48-3;4-Methyl-2-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-5-carboxylic acid methyl ester;1H-1,5-Benzodiazepine-1-carboxylic acid, 2,3,4,5-tetrahydro-2-methyl-4-oxo-, methyl ester;1H-1,5-Benzodiazepine-5-carboxylic acid, 2,3,4,5-tetrahydro-4-methyl-2-oxo-, methyl ester;methyl 2-methyl-4-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-1-carboxylate;Oprea1_868750;DTXSID101008909;STK824809;AKOS002329709;AKOS016037722;CCG-157461;LS-34047;SR-01000528616;SR-01000528616-1;Z452542070;Methyl 4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepine-1-carboxylate

Chemical Property of 4-Methyl-2-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-5-carboxylic acid methyl ester

Chemical Property:

• PSA: 62.13000
• LogP: 2.14020
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 234.10044231
• Heavy Atom Count: 17
• Complexity: 319

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC(=O)NC2=CC=CC=C2N1C(=O)OC

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