3,4-Diaminopyridazine - CAS 61070-98-2
Catalog: |
BB030928 |
Product Name: |
3,4-Diaminopyridazine |
CAS: |
61070-98-2 |
Synonyms: |
pyridazine-3,4-diamine; pyridazine-3,4-diamine |
IUPAC Name: | pyridazine-3,4-diamine |
Description: | 3,4-Diaminopyridazine (CAS# 61070-98-2) is used as a reagent in the synthesis of a series of 1-substituted 4,5-diformyl-[1,2,3]triazole derivatives which are precursors for novel tetraazapentalene derivatives. |
Molecular Weight: | 110.12 |
Molecular Formula: | C4H6N4 |
Canonical SMILES: | C1=CN=NC(=C1N)N |
InChI: | InChI=1S/C4H6N4/c5-3-1-2-7-8-4(3)6/h1-2H,(H2,5,7)(H2,6,8) |
InChI Key: | BXFLYXZXQZSHOZ-UHFFFAOYSA-N |
LogP: | 0.80340 |
Publication Number | Title | Priority Date |
CA-3053985-A1 | Pesticidally active heterocyclic derivatives with sulfur containing substituents | 20170221 |
EP-3585770-A1 | Pesticidally active heterocyclic derivatives with sulfur containing substituents | 20170221 |
US-2019367514-A1 | Pesticidally active heterocyclic derivatives with sulfur containing substituents | 20170221 |
WO-2018153778-A1 | Pesticidally active heterocyclic derivatives with sulfur containing substituents | 20170221 |
AU-2016307233-A1 | 2-(het)aryl-substituted condensed heterocyclic derivatives as pest control agents | 20150807 |
PMID | Publication Date | Title | Journal |
15701006 | 20050216 | Duplex molecular strands based on the 3,6-diaminopyridazine hydrogen bonding motif: amplifying small-molecule self-assembly preferences through preorganization and iterative arrangement of binding residues | Journal of the American Chemical Society |
Complexity: | 74.4 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 110.059246208 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 110.059246208 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 77.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.2 |
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