2,6-Diaminopyridine - CAS 141-86-6
Catalog: |
BB009266 |
Product Name: |
2,6-Diaminopyridine |
CAS: |
141-86-6 |
Synonyms: |
pyridine-2,6-diamine |
IUPAC Name: | pyridine-2,6-diamine |
Description: | 2,6-Diaminopyridine can be used to synthesize pentamidine derivatives which show antitumor activities and DNA binding activities. It can also be used to synthesize N-monocarbamoyl derivatives of symmetrical diamines with antiviral activity. Its derivatives can be used as models of molecular sensor for nucleic acid base detection. |
Molecular Weight: | 109.13 |
Molecular Formula: | C5H7N3 |
Canonical SMILES: | C1=CC(=NC(=C1)N)N |
InChI: | InChI=1S/C5H7N3/c6-4-2-1-3-5(7)8-4/h1-3H,(H4,6,7,8) |
InChI Key: | VHNQIURBCCNWDN-UHFFFAOYSA-N |
Boiling Point: | 285 °C |
Melting Point: | 115-123 °C |
Density: | 1.251 g/cm3 |
Appearance: | Off-white crystal powder/granuale |
Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00006329 |
LogP: | 1.40840 |
GHS Hazard Statement: | H301 (99.15%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P272, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
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PMID | Publication Date | Title | Journal |
23072486 | 20121102 | Formation of oligomeric and macrocyclic ureas based on 2,6-diaminopyridine | The Journal of organic chemistry |
23125662 | 20121001 | Intra- and inter-molecular proton transfer in 2,6-diamino-pyridinium 4-hy-droxy-pyridin-1-ium-2,6-dicarboxyl-ate | Acta crystallographica. Section E, Structure reports online |
22286054 | 20120401 | Synthesis, characterization and biological activities of some new chromium molybdenum and tungsten complexes with 2,6-diaminopyridine | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
22262400 | 20120220 | Template effects in S(N)2 displacements for the preparation of pseudopeptidic macrocycles | Chemistry (Weinheim an der Bergstrasse, Germany) |
22199616 | 20111201 | Tris(acetonitrile-κN){2,6-bis-[(diphenyl-phosphan-yl)amino]-4-eth-oxy-1,3,5-triazine-κP,N,P'}iron(II) bis-(tetra-fluorido-borate) acetonitrile disolvate | Acta crystallographica. Section E, Structure reports online |
Complexity: | 66.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 109.063997236 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 109.063997236 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 64.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.2 |
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