Methyl 5-(acetylamino)-o-anisate
TL;DR: Methyl 5-(acetylamino)-o-anisate (CAS 79893-19-9) is a chemical compound with molecular formula C11H13NO4 and molecular weight 223.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-acetamido-2-methoxybenzoate
Also Known As: methyl5- -o-anisate, Methyl 5-(acetylamino)-o-anisate, methyl 2-methoxy-5-acetamidobenzoate, EINECS 279-333-0, METHYL2-ACETAMIDOBENZOATE
| Molecular Formula | C11H13NO4 |
|---|---|
| Molecular Weight | 223.08 g/mol |
| LogP | 1.4402 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.08446 |
| Heavy Atoms | 16 |
| Complexity | 414.44562 |
Chemical Identifiers
| CAS Number | 79893-19-9 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1)OC)C(=O)OC |
Product Overview
Methyl 5-(acetylamino)-o-anisate (CAS 79893-19-9), with molecular formula C11H13NO4 and molecular weight 223.08 g/mol. IUPAC: methyl 5-acetamido-2-methoxybenzoate.
Chemical Property Profile of Methyl 5-(acetylamino)-o-anisate
Property Insights of Methyl 5-(acetylamino)-o-anisate
The XLogP value of 1.4402 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-(acetylamino)-o-anisate. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-(acetylamino)-o-anisate. Following Lipinski's Rule of Five, Methyl 5-(acetylamino)-o-anisate has 1 hydrogen bond donor(s) and 4 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 Methyl 5-(acetylamino)-o-anisate?
The CAS number of Methyl 5-(acetylamino)-o-anisate is 79893-19-9.
What is the molecular formula of Methyl 5-(acetylamino)-o-anisate?
The molecular formula of Methyl 5-(acetylamino)-o-anisate is C11H13NO4.
What is the molecular weight of Methyl 5-(acetylamino)-o-anisate?
The molecular weight of Methyl 5-(acetylamino)-o-anisate is 223.08 g/mol.
Where can I buy Methyl 5-(acetylamino)-o-anisate?
You can request a quote for Methyl 5-(acetylamino)-o-anisate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-(acetylamino)-o-anisate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-(acetylamino)-o-anisate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.