6H,12H-5,11-Methanodibenzo[b,f][1,5]diazocine
-
CAS Number 252-73-3
-
Catalog Number io-406901
-
Molecular Weight 222.2800
-
SMILES
| Size | QTY | Notes | |
|---|---|---|---|
|
|
|
Add |
No description available for this item
| 1 | 6H,12H-5,11-Methanodibenzo[b,f][1,5]diazocine |
| 2 | unsubstituted Troger's base |
| 3 | SCHEMBL793253 |
| 4 | CHEMBL2272779 |
| 5 | DTXSID20464049 |
| Molecular Formula | C15H14N2 |
|---|---|
| Canonical SMILES | |
| Isomeric SMILES | |
| Molecular Weight | 222.2800 |
| InChIKey | KSIARGPACPDPRD-UHFFFAOYSA-N |
| InChI | InChI=1S/C15H14N2/c1-3-7-14-12(5-1)9-16-11-17(14)10-13-6-2-4-8-15(13)16/h1-8H,9-11H2 |
| XLogP | 3.1000 |
| ExactMass | 222.1157 |
| MonoisotopicMass | 222.1157 |
| TPSA | 6.5000 |
| Complexity | 263.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 2 |
| RotatableBondCount | 0 |
| HeavyAtomCount | 17 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 34 |
| PatentFamilyCount | 17 |
| LiteratureCount | 7 |
