13,14-Diazatricyclo(8.2.1.14,7)tetradeca-4,6,10,12-tetraene

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Basic information

CAS: 73650-67-6
Standard SMILES: c1cc2[nH]c1CCc1ccc([nH]1)CC2
InChIKey: ACKCVPCEULGAGV-UHFFFAOYSA-N
Molecular formula: C12H14N2
Average molar mass: 186.25 g/mol
Monoisotopic mass: 186.11569846

Names & identifiers

Preferred name: 13,14-Diazatricyclo(8.2.1.14,7)tetradeca-4,6,10,12-tetraene
IUPAC: 13,14-diazatricyclo[8.2.1.14,7]tetradeca-1(12),4,6,10-tetraene
English name: 13,14-Diazatricyclo[8.2.1.14,7]tetradeca-4,6,10,12-tetraene
Molecular formula: C12H14N2
Molecular weight: 186.25296

Names & synonyms

13,14-Diazatricyclo(8.2.1.14,7)tetradeca-4,6,10,12-tetraene73650-67-613,14-Diazatricyclo[8.2.1.14,7]tetradeca-4,6,10,12-tetraeneDTXSID502238631~1~H,4~1~H-1,4(2,5)-Dipyrrolacyclohexaphane

Database identifiers

CAS: 73650-67-6
PubChem CID: 144615
DTXSID: DTXSID50223863

Properties

Computed structural properties

XLogP: 2.2
Topological polar surface area: 31.6 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 0
Rotatable bonds: 0
Heavy atoms: 14
Formal charge: 0
Complexity: 162

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Compound notes

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