1330766-26-1 | Cis-5-Tert-Butyl 8A-Ethyl Octahydropyrrolo[3,4-C]Azepine-5,8A(1H)-Dicarboxylate

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Description

• Catalog Number: AI30265
• Chemical Name: Cis-5-Tert-Butyl 8A-Ethyl Octahydropyrrolo[3,4-C]Azepine-5,8A(1H)-Dicarboxylate
• CAS Number: 1330766-26-1
• Molecular Formula: C16H28N2O4
• Molecular Weight: 312.4045
• MDL Number: MFCD20230910
• SMILES: CCOC(=O)[C@@]12CCCN(C[C@H]2CNC1)C(=O)OC(C)(C)C

Computed Properties

• Complexity: 432
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 2
• Heavy Atom Count: 22
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 5
• XLogP3: 1.2