benzene-1,2-didiazonium

C6H4N4+2 — CID 22568635

IUPACbenzene-1,2-didiazonium
SMILESN#[N+]c1ccccc1[N+]#N
InChIInChI=1S/C6H4N4/c7-9-5-3-1-2-4-6(5)10-8/h1-4H/q+2
InChIKeyFKOLVOYBZCYQQJ-UHFFFAOYSA-N
MW132.13 g/mol
LogP2.66
Rot. Bonds

About benzene-1,2-didiazonium

benzene-1,2-didiazonium (PubChem CID 22568635) has the molecular formula C6H4N4+2 and a molecular weight of 132.13 g/mol. Its IUPAC name is benzene-1,2-didiazonium.

Molecular Properties

Compound Namebenzene-1,2-didiazonium
PubChem CID22568635
Molecular FormulaC6H4N4+2
Molecular Weight132.13 g/mol
Exact Mass132.04
IUPAC Namebenzene-1,2-didiazonium
SMILESN#[N+]c1ccccc1[N+]#N
InChIInChI=1S/C6H4N4/c7-9-5-3-1-2-4-6(5)10-8/h1-4H/q+2
InChIKeyFKOLVOYBZCYQQJ-UHFFFAOYSA-N
XLogP2.66
TPSA56.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.13
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Azo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of benzene-1,2-didiazonium?
The IUPAC name of benzene-1,2-didiazonium (CID 22568635) is benzene-1,2-didiazonium.
What is the SMILES notation for benzene-1,2-didiazonium?
The canonical SMILES for benzene-1,2-didiazonium is N#[N+]c1ccccc1[N+]#N.
What is the InChIKey of benzene-1,2-didiazonium?
The InChIKey is FKOLVOYBZCYQQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N4/c7-9-5-3-1-2-4-6(5)10-8/h1-4H/q+2.
What are the key properties of benzene-1,2-didiazonium?
benzene-1,2-didiazonium has a molecular weight of 132.13 g/mol, XLogP of 2.66, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzene-1,2-didiazonium is sourced from PubChem (CID 22568635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).