Hexanedioic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1-[(4-nitrophenyl)methyl] ester, (S)-

Base Information

• Chemical Name: Hexanedioic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1-[(4-nitrophenyl)methyl] ester, (S)-
• CAS No.: 141044-69-1
• Molecular Formula: C18H24N2O8
• DSSTox Substance ID: DTXSID801115618

Synonyms:DTXSID801115618;141044-69-1;Hexanedioic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1-[(4-nitrophenyl)methyl] ester, (S)-

Chemical Property of Hexanedioic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1-[(4-nitrophenyl)methyl] ester, (S)-

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 11
• Exact Mass: 396.15326573
• Heavy Atom Count: 28
• Complexity: 559

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NC(CCCC(=O)O)C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]
• Isomeric SMILES: CC(C)(C)OC(=O)N[C@@H](CCCC(=O)O)C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

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