4-Aminopyrazole - CAS 28466-26-4
Catalog: |
BB019860 |
Product Name: |
4-Aminopyrazole |
CAS: |
28466-26-4 |
IUPAC Name: | 1H-pyrazol-4-amine |
Description: | 4-Aminopyrazole is a versatile building block for the preparation of pharmaceutical and biologically active compounds. 4-Amino-1H-pyrazole, has also shown to have anticonvulsant activity, and thus can be used in the treatment of epileptic seizures. |
Molecular Weight: | 83.09 |
Molecular Formula: | C3H5N3 |
Canonical SMILES: | C1=C(C=NN1)N |
InChI: | InChI=1S/C3H5N3/c4-3-1-5-6-2-3/h1-2H,4H2,(H,5,6) |
InChI Key: | AXINVSXSGNSVLV-UHFFFAOYSA-N |
Boiling Point: | 334.5 °C at 760 mmHg |
Purity: | ≥95% |
Density: | 1.313 g/cm3 |
Storage: | 2 - 8 °C, nitrogen protection |
MDL: | MFCD01693729 |
LogP: | 0.57310 |
GHS Hazard Statement: | H302 (86.67%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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 |
22464424 | 20120601 | 2-Aminothiophenes as building blocks in heterocyclic synthesis: synthesis and antimicrobial evaluation of a new class of pyrido[1,2-a]thieno[3,2-e]pyrimidine, quinoline and pyridin-2-one derivatives | European journal of medicinal chemistry |
21544037 | 20110504 | Acylation of heteroaromatic amines: facile and efficient synthesis of a new class of 1,2,3-triazolo[4,5-b]pyridine and pyrazolo[4,3-b]pyridine derivatives | Molecules (Basel, Switzerland) |
17511860 | 20070518 | Preferential inhibition of xanthine oxidase by 2-amino-6-hydroxy-8-mercaptopurine and 2-amino-6-purine thiol | BMC biochemistry |
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: | -1.1 |
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Amines and Anilines
Pyrazoles
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