isopropyl N-methylanthranilate
TL;DR: isopropyl N-methylanthranilate (CAS 99985-64-5) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-(methylamino)benzoate
Also Known As: propan-2-yl 2-(methylamino)benzoate, Isopropyl 2-(methylamino)benzoate, isopropyl N-methylanthranilate, iso-Propyl N-methyl anthranilate, Isopropyl2-(methylamino)benzoate
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 99985-64-5 |
|---|---|
| SMILES | CC(C)OC(=O)C1=CC=CC=C1NC |
| InChIKey | OBKVPPPSOAFJDS-UHFFFAOYSA-N |
Product Overview
isopropyl N-methylanthranilate (CAS 99985-64-5), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: propan-2-yl 2-(methylamino)benzoate.
Chemical Property Profile of isopropyl N-methylanthranilate
Property Insights of isopropyl N-methylanthranilate
The XLogP value of 3.1 indicates that isopropyl N-methylanthranilate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, isopropyl N-methylanthranilate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, isopropyl 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 isopropyl N-methylanthranilate?
The CAS number of isopropyl N-methylanthranilate is 99985-64-5.
What is the molecular formula of isopropyl N-methylanthranilate?
The molecular formula of isopropyl N-methylanthranilate is C11H15NO2.
What is the molecular weight of isopropyl N-methylanthranilate?
The molecular weight of isopropyl N-methylanthranilate is 193.11 g/mol.
Where can I buy isopropyl N-methylanthranilate?
You can request a quote for isopropyl N-methylanthranilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for isopropyl N-methylanthranilate?
Yes, KEHONG BIO provides custom synthesis services for isopropyl N-methylanthranilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.