3-Aminopyrazole - CAS 1820-80-0
Catalog: |
BB013868 |
Product Name: |
3-Aminopyrazole |
CAS: |
1820-80-0 |
Synonyms: |
Pyrazole, 3(or 5)-amino-; Pyrazole, 3-amino-; (5-1H-Pyrazolyl)amine; 1H-Pyrazol-3-ylamine; 1H-Pyrazol-5-amine; 1H-Pyrazole-3-amine; 2H-Pyrazol-3-ylamine; 3(5)-Aminopyrazole; 3-Amino-1H-pyrazole; 3-Amino-2H-pyrazole; 3-Aminopyrazole; 3-AP; 5-Aminopyrazole; 5-Pyrazolamine; NSC 76122 |
Related CAS: | 1225387-53-0 (Alternate CAS)
|
IUPAC Name: | 1H-pyrazol-3-amine |
Description: | Used in the preparation of heterocyclic compounds of pharamaceutical interest. |
Molecular Weight: | 83.09 |
Molecular Formula: | C3H5N3 |
Canonical SMILES: | C1=C(NN=C1)N |
InChI: | InChI=1S/C3H5N3/c4-3-1-2-5-6-3/h1-2H,(H3,4,5,6) |
InChI Key: | JVVRJMXHNUAPHW-UHFFFAOYSA-N |
Boiling Point: | 146-148°C at 11 Torr |
Melting Point: | 36-38°C |
Purity: | ≥95% |
Density: | 1.313±0.06 g/cm3 |
Solubility: | Soluble in Methanol |
Appearance: | White to Light Yellow Oily Liquid or Crystalline Low Melting Solid |
Storage: | Store at 2-8°C under inert atmosphere |
MDL: | MFCD00005236 |
LogP: | 0.57310 |
GHS Hazard Statement: | H302 (93.75%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P260, P261, P264, P270, P272, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P333+P313, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2019177279-A1 | Carboxylic acid aromatic 1,2-cyclopropylamides | 20171213 |
AU-2017381629-A1 | Carboxylic acid aromatic amides as antagonists of Bradykinin B1 receptor | 20161223 |
BR-112019012920-A2 | aromatic carboxylic acid amides as bradykinin b1 receptor antagonists | 20161223 |
CA-3047812-A1 | Tetrazole containing compounds | 20161223 |
CA-3047815-A1 | Carboxylic acid aromatic amides as antagonists of bradykinin b1 receptor | 20161223 |
PMID | Publication Date | Title | Journal |
30108985 | 20180601 | N-Acetyl-3-aminopyrazoles block the non-canonical NF-kB cascade by selectively inhibiting NIK | MedChemComm |
24354345 | 20140213 | Discovery of highly potent, selective, and brain-penetrant aminopyrazole leucine-rich repeat kinase 2 (LRRK2) small molecule inhibitors | Journal of medicinal chemistry |
22891248 | 20121005 | Discovery and structure activity relationship of small molecule inhibitors of toxic β-amyloid-42 fibril formation | The Journal of biological chemistry |
23022735 | 20121001 | Synthesis, antitumor, cytotoxic and antioxidant evaluation of some new pyrazolotriazines attached to antipyrine moiety | European journal of medicinal chemistry |
22536852 | 20120521 | Isostructural dinuclear phenoxo-/acetato-bridged manganese(II), cobalt(II), and zinc(II) complexes with labile sites: kinetics of transesterification of 2-hydroxypropyl-p-nitrophenylphosphate | Inorganic chemistry |
Complexity: | 45.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 83.048347172 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 83.048347172 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 54.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Amines and Anilines
Pyrazoles
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS