Methyl N-methylanthranilate
TL;DR: Methyl N-methylanthranilate (CAS 85-91-6) is a chemical compound with molecular formula C9H11NO2 and molecular weight 165.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(methylamino)benzoate
Also Known As: Methyl 2-(methylamino)benzoate, Dimethyl anthranilate, METHYL N-METHYLANTHRANILATE, Methyl methylaminobenzoate, Methyl methanthranilate
| Molecular Formula | C9H11NO2 |
|---|---|
| Molecular Weight | 165.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 165.07898 |
| Heavy Atoms | 12 |
| Complexity | 159.0 |
| Melting Point | 18.5-19.5 °C |
| Boiling Point | 256 °C @ 760 MM HG |
| Density | 1.120 @ 15 °C |
| Solubility | INSOL IN WATER; SOL IN ALCOHOL, ETHER |
| Flash Point | 91 °C |
| Refractive Index | 1.5785-1.5810 (1.5800-1.5810) @ 20 °C |
Chemical Identifiers
| CAS Number | 85-91-6 |
|---|---|
| SMILES | CNC1=CC=CC=C1C(=O)OC |
| InChIKey | GVOWHGSUZUUUDR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl N-methylanthranilate (CAS 85-91-6), with molecular formula C9H11NO2 and molecular weight 165.08 g/mol. IUPAC: methyl 2-(methylamino)benzoate.
Chemical Property Profile of Methyl N-methylanthranilate
Property Insights of Methyl N-methylanthranilate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl N-methylanthranilate. With a topological polar surface area (TPSA) of 38.3 Ų, Methyl N-methylanthranilate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl N-methylanthranilate has 1 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 Methyl N-methylanthranilate?
The CAS number of Methyl N-methylanthranilate is 85-91-6.
What is the molecular formula of Methyl N-methylanthranilate?
The molecular formula of Methyl N-methylanthranilate is C9H11NO2.
What is the molecular weight of Methyl N-methylanthranilate?
The molecular weight of Methyl N-methylanthranilate is 165.08 g/mol.
Where can I buy Methyl N-methylanthranilate?
You can request a quote for Methyl N-methylanthranilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl N-methylanthranilate?
Yes, KEHONG BIO provides custom synthesis services for Methyl N-methylanthranilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.