3,6-Di(2-pyridinyl)-1,2-dihydro-1,2,4,5-tetraazine
Basic information
- CAS
1671-86-9- Standard SMILES
c1ccc(C2=NNC(c3ccccn3)=NN2)nc1- InChIKey
QGNCLGGVWYZSSZ-UHFFFAOYSA-N- Molecular formula
- C12H10N6
- Average molar mass
- 238.25 g/mol
- Monoisotopic mass
- 238.09669434
Overview
See also: 3,6-DI-Pyridin-2-YL-1,2-dihydro-(1,2,4,5)tetrazine (annotation moved to).
Names & identifiers
- Preferred name
- 3,6-Di(2-pyridinyl)-1,2-dihydro-1,2,4,5-tetraazine
- IUPAC
- 3,6-dipyridin-2-yl-1,4-dihydro-1,2,4,5-tetrazine
- English name
- 1,2,4,5-Tetrazine,1,4-dihydro-3,6-di-2-pyridinyl-
- Molecular formula
- C12H10N6
- Molecular weight
- 238.25
Names & synonyms
1671-86-93,6-Di(2-pyridinyl)-1,2-dihydro-1,2,4,5-tetraazine3,6-Di(pyridin-2-yl)-1,2-dihydro-1,2,4,5-tetrazine3,6-dipyridin-2-yl-1,4-dihydro-1,2,4,5-tetrazine1,2,4,5-Tetrazine,1,4-dihydro-3,6-di-2-pyridinyl-3,6-di(pyridin-2-yl)-1,4-dihydro-1,2,4,5-tetrazineMFCD001402291,2,4,5-Tetrazine, 1,4-dihydro-3,6-di-2-pyridinyl-3,6-Bis(pyridin-2-yl)-1,4-dihydro-1,2,4,5-tetrazineNSC1449363,6-bis(pyridin-2-yl)-1,2-dihydro-1,2,4,5-tetrazines-Tetrazine, 1,2-dihydro-3,6-di-2-pyridyl-
Show more names
3,6-bis(2-pyridyl)-1,2-dihydro-1,2,4,5-tetrazineorb3216463SCHEMBL37170761,2,4,5-Tetrazine, 1,2-dihydro-3,6-di-2-pyridinyl-CHEMBL1307262SCHEMBL13941189SCHEMBL29573007DTXSID20301607
Database identifiers
- CAS
1671-86-9- PubChem CID
- 286497
- DTXSID
DTXSID20301607- ChEMBL
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 316
Experimental & physicochemical properties
Solubility20.8 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315-H302
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H315-H302
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
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Related reactions
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Compound notes
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