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Phthalazine information


Phthalazine[1]
Skeletal formula of phthalazine
Ball-and-stick model of the phthalazine molecule
Names
Preferred IUPAC name
Phthalazine[2]
Other names
Benzo-orthodiazine
2,3-Benzodiazine
Benzo[d]pyridazine
Identifiers
CAS Number
  • 253-52-1 checkY
3D model (JSmol)
  • Interactive image
ChemSpider
  • 8852 ☒N
ECHA InfoCard 100.005.422 Edit this at Wikidata
PubChem CID
  • 9207
UNII
  • 91Y28DM24N checkY
CompTox Dashboard (EPA)
  • DTXSID9049407 Edit this at Wikidata
InChI
  • InChI=1S/C8H6N2/c1-2-4-8-6-10-9-5-7(8)3-1/h1-6H ☒N
    Key: LFSXCDWNBUNEEM-UHFFFAOYSA-N ☒N
  • InChI=1/C8H6N2/c1-2-4-8-6-10-9-5-7(8)3-1/h1-6H
    Key: LFSXCDWNBUNEEM-UHFFFAOYAE
SMILES
  • C1=CC=C2C=NN=CC2=C1
Properties
Chemical formula
C8H6N2
Molar mass 130.150 g·mol−1
Appearance Pale yellow needles
Melting point 90 to 91 °C (194 to 196 °F; 363 to 364 K)
Boiling point 315 to 317 °C (599 to 603 °F; 588 to 590 K) (decomposition)
Solubility in water
Miscible
Acidity (pKa) 3.39[3]
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
☒N verify (what is checkY☒N ?)
Infobox references

Phthalazine, also called benzo-orthodiazine or benzopyridazine, is a heterocyclic organic compound with the molecular formula C8H6N2. It is isomeric with other naphthyridines including quinoxaline, cinnoline and quinazoline.

  1. ^ Merck Index, 11th Edition, 7344.
  2. ^ Nomenclature of Organic Chemistry : IUPAC Recommendations and Preferred Names 2013 (Blue Book). Cambridge: The Royal Society of Chemistry. 2014. p. 212. doi:10.1039/9781849733069-FP001. ISBN 978-0-85404-182-4.
  3. ^ Brown, H.C., et al., in Baude, E.A. and Nachod, F.C., Determination of Organic Structures by Physical Methods, Academic Press, New York, 1955.

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Phthalazine, also called benzo-orthodiazine or benzopyridazine, is a heterocyclic organic compound with the molecular formula C8H6N2. It is isomeric with...

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Simple aromatic ring

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List of compounds with carbon number 8

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