3-Methoxyacetaminophen
TL;DR: 3-Methoxyacetaminophen (CAS 1246816-53-4) is a chemical compound with molecular formula C9H11NO3 and molecular weight 181.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-hydroxy-3-methoxyphenyl)acetamide
Also Known As: 3-Methoxyacetaminophen, 3-Methoxy Acetaminophen, N-(4-hydroxy-3-methoxyphenyl)acetamide, 3-methoxyparacetamol, 3-methoxy APAP
| Molecular Formula | C9H11NO3 |
|---|---|
| Molecular Weight | 181.07 g/mol |
| LogP | 1.3592 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.0739 |
| Heavy Atoms | 13 |
| Complexity | 322.6359 |
Chemical Identifiers
| CAS Number | 1246816-53-4 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1)O)OC |
Product Overview
3-Methoxyacetaminophen (CAS 1246816-53-4), with molecular formula C9H11NO3 and molecular weight 181.07 g/mol. IUPAC: N-(4-hydroxy-3-methoxyphenyl)acetamide.
Chemical Property Profile of 3-Methoxyacetaminophen
Property Insights of 3-Methoxyacetaminophen
The XLogP value of 1.3592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxyacetaminophen. With a topological polar surface area (TPSA) of 58.56 Ų, 3-Methoxyacetaminophen exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxyacetaminophen has 2 hydrogen bond donor(s) and 3 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 3-Methoxyacetaminophen?
The CAS number of 3-Methoxyacetaminophen is 1246816-53-4.
What is the molecular formula of 3-Methoxyacetaminophen?
The molecular formula of 3-Methoxyacetaminophen is C9H11NO3.
What is the molecular weight of 3-Methoxyacetaminophen?
The molecular weight of 3-Methoxyacetaminophen is 181.07 g/mol.
Where can I buy 3-Methoxyacetaminophen?
You can request a quote for 3-Methoxyacetaminophen directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxyacetaminophen?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxyacetaminophen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.