2,4,6-Triaminobenzene-1,3,5-triol
CAS: 114491-15-5
| 1 | 2,4,6-Triaminobenzene-1,3,5-triol |
No description available for this item
| Molecular Formula | C6H9N3O3 |
|---|---|
| Canonical SMILES | - |
| Isomeric SMILES | C1(=C(C(=C(C(=C1O)N)O)N)O)N |
| Molecular Weight | 171.1500 |
| InChIKey | DANSOQBUORNSEY-UHFFFAOYSA-N |
| InChI | InChI=1S/C6H9N3O3/c7-1-4(10)2(8)6(12)3(9)5(1)11/h10-12H,7-9H2 |
| XLogP | -1.2000 |
| ExactMass | 171.0600 |
| MonoisotopicMass | 171.0600 |
| TPSA | 139.0000 |
| Complexity | 122.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 6 |
| HBondAcceptorCount | 6 |
| RotatableBondCount | 0 |
| HeavyAtomCount | 12 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 14 |
| PatentFamilyCount | 9 |
| LiteratureCount | 3 |