1,4-Diazidobenzene
Basic information
- CAS
2294-47-5- Standard SMILES
N#[N+]N=C1C=CC(=NN=[N-])C=C1- InChIKey
QNSQTJHTVQSWFR-UHFFFAOYSA-N- Molecular formula
- C6H4N6
- Average molar mass
- 160.14 g/mol
- Monoisotopic mass
- 160.04974415
Names & identifiers
- Preferred name
- 1,4-Diazidobenzene
- IUPAC
- [(4-diazonioiminocyclohexa-2,5-dien-1-ylidene)hydrazinylidene]azanide
- English name
- 1,4-Diazido Benzene
- Molecular formula
- C6H4N6
- Molecular weight
- 160.13616
Names & synonyms
1,4-diazidobenzene2294-47-5DTXSID20945621RefChem:1053249DTXCID401373933P-DIAZIDOBENZENEp-Diazidobenzene [Forbidden]1,4-DIAZIDO BENZENE[(4-diazonioiminocyclohexa-2,5-dien-1-ylidene)hydrazinylidene]azanideSCHEMBL16748959QNSQTJHTVQSWFR-UHFFFAOYSA-DB-225953
Show more names
p-Phenylenebisazidep-Phenylene Diazide1,4-PhenylenediazideBenzene, 1,4-diazido-1,4-Diazido Benzene DISCONTINUED
InChI=1/C6H4N6/c7-11-9-5-1-2-6(4-3-5)10-12-8/h1-4H
Database identifiers
- CAS
2294-47-5- PubChem CID
- 61291
- DTXSID
DTXSID20945621- Nikkaji
- J830.323A
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 66.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 299
Physicochemical properties
- Melting point
- 83 °C · 83°C
- Boiling point
- 276.02 °C · 276.02°C (rough estimate)
- Density
- 1.4978 · 1.4978 (rough estimate)
- refractive index
- 1.83 · 1.8300 (estimate)
- CAS DataBase Reference
- 2294 · 2294-47-5
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
DOT Hazard Classification
p-Diazidobenzene
Forbidden explosives/materials (49 eCFR § 173.54/§ 173.21)
Chemistry & industry
Applications
Uses1,4-Diazido Benzene is versatile intermediate with a diverse range of applications in organic and bioorganic chemistry, with their use as photoaffinity labeling reagents.
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Related reactions
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Compound notes
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