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3,5-Diazatetracyclo[5.4.0.02,9.04,8]Undeca-1(7),2(9),3,5,10-Pentaene
[CAS# 168040-84-4]
Identification
| Name |
3,5-Diazatetracyclo[5.4.0.02,9.04,8]Undeca-1(7),2(9),3,5,10-Pentaene |
|---|
| Synonyms |
2,5,8-(epimethanetriyl)cyclopenta[d][1,3]diazepine |
|
| Molecular Structure |
![CAS#: 168040-84-4, 3,5-Diazatetracyclo[5.4.0.0<Sup>2,9</Sup>.0<Sup>4,8</Sup>]Undeca-1(7),2(9),3,5,10-Pentaene](/moreStructures/168040-84-4.gif) |
| Molecular Formula |
C9H4N2 |
| Molecular Weight |
140.14 |
| CAS Registry Number |
168040-84-4 |
| SMILES |
c1cc2c-3nc4ncc(c13)C24 |
| InChI |
1S/C9H4N2/c1-2-5-7-6-3-10-9(7)11-8(5)4(1)6/h1-3,7H |
| InChIKey |
YTIMVDRZDTXQBI-UHFFFAOYSA-N |
|
Properties
| Density |
1.929g/cm3 (Cal.) |
|---|
| Boiling point |
479.66°C at 760 mmHg (Cal.) |
| Flash point |
236.801°C (Cal.) |
| Refractive index |
2.159 (Cal.) |
|
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