N-(4-Azido-2-nitrophenyl)-beta-alanine

Base Information

• Chemical Name: N-(4-Azido-2-nitrophenyl)-beta-alanine
• CAS No.: 58775-35-2
• Molecular Formula: C9H9N5O4
• DSSTox Substance ID: DTXSID10568020
• Nikkaji Number: J1.222.747G
• Wikidata: Q82454134

Synonyms:N-(4-Azido-2-nitrophenyl)-beta-alanine;58775-35-2;3-(4-azido-2-nitroanilino)propanoic acid;3-(N-(4-azido-2-nitrophenyl)-amino)propionic acid;3-[N-(4-azido-2-nitrophenyl)-amino]propionic acid;DTXSID10568020;WBDBRCKAXAMLMR-UHFFFAOYSA-N

Chemical Property of N-(4-Azido-2-nitrophenyl)-beta-alanine

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 251.06545379
• Heavy Atom Count: 18
• Complexity: 363

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1N=[N+]=[N-])[N+](=O)[O-])NCCC(=O)O

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