sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium

C32H24CrN8NaO8+ — CID 170844440

About sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium

sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium (PubChem CID 170844440) has the molecular formula C32H24CrN8NaO8+ and a molecular weight of 723.58 g/mol. Its IUPAC name is sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium.

Molecular Properties

• Compound Name: sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium
• PubChem CID: 170844440
• Molecular Formula: C32H24CrN8NaO8+
• Molecular Weight: 723.58 g/mol
• Exact Mass: 723.10
• IUPAC Name: sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium
• SMILES: Nc1cccc2ccc(O)c(/N=N/c3ccc([N+](=O)[O-])cc3O)c12.Nc1cccc2ccc(O)c(/N=N/c3ccc([N+](=O)[O-])cc3O)c12.[Cr].[Na+]
• InChI: InChI=1S/2C16H12N4O4.Cr.Na/c2*17-11-3-1-2-9-4-7-13(21)16(15(9)11)19-18-12-6-5-10(20(23)24)8-14(12)22;;/h2*1-8,21-22H,17H2;;/q;;;+1/b2*19-18+
• InChIKey: PEFPNPCLGAUCLG-HFJGHOORSA-N
• XLogP: 5.32
• TPSA: 268.68 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 14
• Rotatable Bonds: 6
• Heavy Atoms: 50
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	723.58
LogP ≤ 5	5.32
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium?

The IUPAC name of sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium (CID 170844440) is sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium.

What is the SMILES notation for sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium?

The canonical SMILES for sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium is Nc1cccc2ccc(O)c(/N=N/c3ccc([N+](=O)[O-])cc3O)c12.Nc1cccc2ccc(O)c(/N=N/c3ccc([N+](=O)[O-])cc3O)c12.[Cr].[Na+].

What is the InChIKey of sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium?

The InChIKey is PEFPNPCLGAUCLG-HFJGHOORSA-N. The full InChI is InChI=1S/2C16H12N4O4.Cr.Na/c2*17-11-3-1-2-9-4-7-13(21)16(15(9)11)19-18-12-6-5-10(20(23)24)8-14(12)22;;/h2*1-8,21-22H,17H2;;/q;;;+1/b2*19-18+;;.

What are the key properties of sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium?

sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium has a molecular weight of 723.58 g/mol, XLogP of 5.32, 6 rotatable bonds, 6 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for sodium;bis(8-amino-1-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-2-ol);chromium is sourced from PubChem (CID 170844440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).