Aminopyrine
TL;DR: Aminopyrine (CAS 58-15-1) is a chemical compound with molecular formula C13H17N3O and molecular weight 231.13716 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(dimethylamino)-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: aminophenazone, AMINOPYRINE, Amidopyrine, Dipyrine, Amidopyrazoline
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H17N3O |
| Molecular Weight | 231.13716 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 26.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.13716 Da |
| Heavy Atoms | 17 |
| Complexity | 343.0 |
| Melting Point | 225 to 228 °F (NTP, 1992) |
| Refractive Index | INDEX OF REFRACTION: ALPHA 1.520, GAMMA 1.732 |
| Solubility | greater than or equal to 100 mg/mL at 72 °F (NTP, 1992) |
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)C |
| InChIKey | RMMXTBMQSGEXHJ-UHFFFAOYSA-N |
Product Description
Applications: Aminopyrine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Aminopyrine is a pharmaceutical intermediate identified by CAS number 58-15-1 and the molecular formula C13H17N3O and a molecular weight of 231.14 g/mol. Physically, the compound has a solubility: greater than or equal to 100 mg/mL at 72 °F (NTP, 1992). Synonyms include aminophenazone and AMINOPYRINE.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Aminopyrine
Property Insights of Aminopyrine
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aminopyrine. With a topological polar surface area (TPSA) of 26.8 Ų, Aminopyrine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aminopyrine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Aminopyrine?
The CAS number of Aminopyrine is 58-15-1.
What is the molecular formula of Aminopyrine?
The molecular formula of Aminopyrine is C13H17N3O.
What is the molecular weight of Aminopyrine?
The molecular weight of Aminopyrine is 231.13716 g/mol.
What are the applications of Aminopyrine?
Aminopyrine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Aminopyrine?
You can request a quote for Aminopyrine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Aminopyrine?
Yes, CoreyChem provides custom synthesis services for Aminopyrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.