1,4-Diazepine

1,4-Diazepine
Structural formula of 1,4-diazepine
Ball-and-stick model of the 1,4-diazepine molecule
Names
IUPAC names
Tautomer with N-H bond: 1H-1,4-diazepine
(the structure shown above)
Tautomer without N-H bond: 2H-1,4-diazepine
Identifiers
CAS Number
  • 334-23-6 ☒N
  • 292-04-6
3D model (JSmol)
  • Interactive image
  • Interactive image
ChemSpider
  • 10629939 checkY
PubChem CID
  • 12312963
  • 21940662
CompTox Dashboard (EPA)
  • DTXSID60487414 Edit this at Wikidata
InChI
  • InChI=1S/C5H6N2/c1-2-6-4-5-7-3-1/h1-4H,5H2 checkY
    Key: JTDPQPJEFUAAGO-UHFFFAOYSA-N checkY
  • InChI=1/C5H6N2/c1-2-6-4-5-7-3-1/h1-4H,5H2
    Key: JTDPQPJEFUAAGO-UHFFFAOYAC
  • C1C=NC=CC=N1
  • C1=C\C=N/C\C=N1
Properties
Chemical formula
 C5H6N2
Molar mass 94.11454
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
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Infobox references
Chemical compound

1,4-Diazepine is a diazepine. It is a core element in the structure of benzodiazepines and thienodiazepines.


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