4-Aminoantipyrine phosphate
TL;DR: 4-Aminoantipyrine phosphate (CAS 68258-97-9) is a chemical compound with molecular formula C11H16N3O5P and molecular weight 301.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-1,5-dimethyl-2-phenyl-1H-pyrazol-1-ium-3-one;dihydrogen phosphate
Also Known As: 4-Aminoantipyrine phosphate, 4-amino-1,5-dimethyl-2-phenyl-1,2-dihydro-3h-pyrazol-3-one phosphate(1:1), 3H-Pyrazol-3-one, 4-amino-1,2-dihydro-1,5-dimethyl-2-phenyl-, phosphate (1:1), 4-Amino-1,2-dihydro-1,5-dimethyl-3-oxo-2-phenyl-3H-pyrazolium dihydrogen phosphate, 4-amino-1,5-dimethyl-2-phenyl-1H-pyrazol-1-ium-3-one; dihydrogen phosphate
| Molecular Formula | C11H16N3O5P |
|---|---|
| Molecular Weight | 301.08 g/mol |
| LogP | -1.91 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 301.08276 |
| Heavy Atoms | 20 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 68258-97-9 |
|---|---|
| SMILES | CC1=C(C(=O)N([NH+]1C)C2=CC=CC=C2)N.OP(=O)(O)[O-] |
| InChIKey | CUDGKHKIJQRRAJ-UHFFFAOYSA-N |
Product Overview
4-Aminoantipyrine phosphate (CAS 68258-97-9), with molecular formula C11H16N3O5P and molecular weight 301.08 g/mol. IUPAC: 4-amino-1,5-dimethyl-2-phenyl-1H-pyrazol-1-ium-3-one;dihydrogen phosphate.
Chemical Property Profile of 4-Aminoantipyrine phosphate
Property Insights of 4-Aminoantipyrine phosphate
The XLogP value of -1.91 indicates that 4-Aminoantipyrine phosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Aminoantipyrine phosphate. Following Lipinski's Rule of Five, 4-Aminoantipyrine phosphate has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Aminoantipyrine phosphate?
The CAS number of 4-Aminoantipyrine phosphate is 68258-97-9.
What is the molecular formula of 4-Aminoantipyrine phosphate?
The molecular formula of 4-Aminoantipyrine phosphate is C11H16N3O5P.
What is the molecular weight of 4-Aminoantipyrine phosphate?
The molecular weight of 4-Aminoantipyrine phosphate is 301.08 g/mol.
Where can I buy 4-Aminoantipyrine phosphate?
You can request a quote for 4-Aminoantipyrine phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Aminoantipyrine phosphate?
Yes, KEHONG BIO provides custom synthesis services for 4-Aminoantipyrine phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.