phenyl(phenyldiazenylmethyl)diazene

C13H12N4 — CID 12897221

IUPACphenyl(phenyldiazenylmethyl)diazene
SMILESc1ccc(/N=N/C/N=N/c2ccccc2)cc1
InChIInChI=1S/C13H12N4/c1-3-7-12(8-4-1)16-14-11-15-17-13-9-5-2-6-10-13/h1-10H,11H2/b16-14+,17-15+
InChIKeyXSUZPNDVDSSCRA-YXLFCKQPSA-N
MW224.27 g/mol
LogP4.51
Rot. Bonds4

About phenyl(phenyldiazenylmethyl)diazene

phenyl(phenyldiazenylmethyl)diazene (PubChem CID 12897221) has the molecular formula C13H12N4 and a molecular weight of 224.27 g/mol. Its IUPAC name is phenyl(phenyldiazenylmethyl)diazene.

Molecular Properties

Compound Namephenyl(phenyldiazenylmethyl)diazene
PubChem CID12897221
Molecular FormulaC13H12N4
Molecular Weight224.27 g/mol
Exact Mass224.11
IUPAC Namephenyl(phenyldiazenylmethyl)diazene
SMILESc1ccc(/N=N/C/N=N/c2ccccc2)cc1
InChIInChI=1S/C13H12N4/c1-3-7-12(8-4-1)16-14-11-15-17-13-9-5-2-6-10-13/h1-10H,11H2/b16-14+,17-15+
InChIKeyXSUZPNDVDSSCRA-YXLFCKQPSA-N
XLogP4.51
TPSA49.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of phenyl(phenyldiazenylmethyl)diazene?
The IUPAC name of phenyl(phenyldiazenylmethyl)diazene (CID 12897221) is phenyl(phenyldiazenylmethyl)diazene.
What is the SMILES notation for phenyl(phenyldiazenylmethyl)diazene?
The canonical SMILES for phenyl(phenyldiazenylmethyl)diazene is c1ccc(/N=N/C/N=N/c2ccccc2)cc1.
What is the InChIKey of phenyl(phenyldiazenylmethyl)diazene?
The InChIKey is XSUZPNDVDSSCRA-YXLFCKQPSA-N. The full InChI is InChI=1S/C13H12N4/c1-3-7-12(8-4-1)16-14-11-15-17-13-9-5-2-6-10-13/h1-10H,11H2/b16-14+,17-15+.
What are the key properties of phenyl(phenyldiazenylmethyl)diazene?
phenyl(phenyldiazenylmethyl)diazene has a molecular weight of 224.27 g/mol, XLogP of 4.51, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl(phenyldiazenylmethyl)diazene is sourced from PubChem (CID 12897221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).