3-Nitro-4-(6-Aminohexylamido)Phenylboronic Acid
[CAS# 80500-29-4]

Identification

• Name: 3-Nitro-4-(6-Aminohexylamido)Phenylboronic Acid
• Synonyms: [4-(6-Aminohexylcarbamoyl)-3-Nitro-Phenyl]Boronic Acid; [4-[(6-Aminohexylamino)-Oxomethyl]-3-Nitrophenyl]Boronic Acid; (4-(((6-Aminohexyl)Amino)Carbonyl)-3-Nitrophenyl)Boronic Acid
• Molecular Formula: C₁₃H₂₀BN₃O₅
• Molecular Weight: 309.13
• CAS Registry Number: 80500-29-4
• SMILES: C1=C([N+]([O-])=O)C(=CC=C1B(O)O)C(=O)NCCCCCCN
• InChI: 1S/C13H20BN3O5/c15-7-3-1-2-4-8-16-13(18)11-6-5-10(14(19)20)9-12(11)17(21)22/h5-6,9,19-20H,1-4,7-8,15H2,(H,16,18)
• InChIKey: VDHUVZLEHHHMRS-UHFFFAOYSA-N

Properties

• Density: 1.281g/cm³ (Cal.)