2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde

C19H14N4O2 — CID 3020935

IUPAC2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde
SMILESO=Cc1cc(/N=N/c2ccc(/N=N/c3ccccc3)cc2)ccc1O
InChIInChI=1S/C19H14N4O2/c24-13-14-12-18(10-11-19(14)25)23-22-17-8-6-16(7-9-17)21-20-15-4-2-1-3-5-15/h1-13,25H/b21-20+,23-22+
InChIKeyFZGQMLKOUBTYCX-RLJRJAJVSA-N
MW330.35 g/mol
LogP6.04
Rot. Bonds5

About 2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde

2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde (PubChem CID 3020935) has the molecular formula C19H14N4O2 and a molecular weight of 330.35 g/mol. Its IUPAC name is 2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde.

Molecular Properties

Compound Name2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde
PubChem CID3020935
Molecular FormulaC19H14N4O2
Molecular Weight330.35 g/mol
Exact Mass330.11
IUPAC Name2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde
SMILESO=Cc1cc(/N=N/c2ccc(/N=N/c3ccccc3)cc2)ccc1O
InChIInChI=1S/C19H14N4O2/c24-13-14-12-18(10-11-19(14)25)23-22-17-8-6-16(7-9-17)21-20-15-4-2-1-3-5-15/h1-13,25H/b21-20+,23-22+
InChIKeyFZGQMLKOUBTYCX-RLJRJAJVSA-N
XLogP6.04
TPSA86.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.35
LogP ≤ 56.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde?
The IUPAC name of 2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde (CID 3020935) is 2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde.
What is the SMILES notation for 2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde?
The canonical SMILES for 2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde is O=Cc1cc(/N=N/c2ccc(/N=N/c3ccccc3)cc2)ccc1O.
What is the InChIKey of 2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde?
The InChIKey is FZGQMLKOUBTYCX-RLJRJAJVSA-N. The full InChI is InChI=1S/C19H14N4O2/c24-13-14-12-18(10-11-19(14)25)23-22-17-8-6-16(7-9-17)21-20-15-4-2-1-3-5-15/h1-13,25H/b21-20+,23-22+.
What are the key properties of 2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde?
2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde has a molecular weight of 330.35 g/mol, XLogP of 6.04, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-[(4-phenyldiazenylphenyl)diazenyl]benzaldehyde is sourced from PubChem (CID 3020935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).