Acetaminophen-Aspirin-Caffeine mixt.
TL;DR: Acetaminophen-Aspirin-Caffeine mixt. (CAS 53908-21-7) is a chemical compound with molecular formula C32H34N6O10 and molecular weight 662.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetyloxybenzoic acid;2-hydroxybenzamide;N-(4-hydroxyphenyl)acetamide;1,3,7-trimethylpurine-2,6-dione
Also Known As: Exaprin, Excedrin, Excedrin Migraine, EXCEDRIN (MIGRAINE), Acetaminophen-Aspirin-Caffeine mixt.
| Molecular Formula | C32H34N6O10 |
|---|---|
| Molecular Weight | 662.23 g/mol |
| LogP | 2.1225 |
| Topological Polar Surface Area | 235.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 662.23364 |
| Heavy Atoms | 48 |
| Complexity | 779.0 |
Chemical Identifiers
| CAS Number | 53908-21-7 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)O.CC(=O)OC1=CC=CC=C1C(=O)O.CN1C=NC2=C1C(=O)N(C(=O)N2C)C.C1=CC=C(C(=C1)C(=O)N)O |
| InChIKey | SZSLUWXHMBOZRZ-UHFFFAOYSA-N |
Product Overview
Acetaminophen-Aspirin-Caffeine mixt. (CAS 53908-21-7), with molecular formula C32H34N6O10 and molecular weight 662.23 g/mol. IUPAC: 2-acetyloxybenzoic acid;2-hydroxybenzamide;N-(4-hydroxyphenyl)acetamide;1,3,7-trimethylpurine-2,6-dione.
Chemical Property Profile of Acetaminophen-Aspirin-Caffeine mixt.
Property Insights of Acetaminophen-Aspirin-Caffeine mixt.
The XLogP value of 2.1225 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetaminophen-Aspirin-Caffeine mixt.. The TPSA of 235.0 Ų indicates high polarity, suggesting Acetaminophen-Aspirin-Caffeine mixt. may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Acetaminophen-Aspirin-Caffeine mixt. has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Acetaminophen-Aspirin-Caffeine mixt.?
The CAS number of Acetaminophen-Aspirin-Caffeine mixt. is 53908-21-7.
What is the molecular formula of Acetaminophen-Aspirin-Caffeine mixt.?
The molecular formula of Acetaminophen-Aspirin-Caffeine mixt. is C32H34N6O10.
What is the molecular weight of Acetaminophen-Aspirin-Caffeine mixt.?
The molecular weight of Acetaminophen-Aspirin-Caffeine mixt. is 662.23 g/mol.
Where can I buy Acetaminophen-Aspirin-Caffeine mixt.?
You can request a quote for Acetaminophen-Aspirin-Caffeine mixt. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetaminophen-Aspirin-Caffeine mixt.?
Yes, KEHONG BIO provides custom synthesis services for Acetaminophen-Aspirin-Caffeine mixt. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.