2-Nitrophenyl (2-methylphenoxy)acetate
TL;DR: 2-Nitrophenyl (2-methylphenoxy)acetate (CAS 118734-37-5) is a chemical compound with molecular formula C15H13NO5 and molecular weight 287.07938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-nitrophenyl) 2-(2-methylphenoxy)acetate
Also Known As: 2-nitrophenyl (2-methylphenoxy)acetate, (2-nitrophenyl) 2-(2-methylphenoxy)acetate, 2-nitrophenyl 2-(o-tolyloxy)acetate, 2-nitrophenyl 2-(2-methylphenoxy)acetate, AN-329/41306884
Technical Specifications
| Molecular Formula | C15H13NO5 |
| Molecular Weight | 287.07938 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 81.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 287.07938 Da |
| Heavy Atoms | 21 |
| Complexity | 368.0 |
| SMILES | CC1=CC=CC=C1OCC(=O)OC2=CC=CC=C2[N+](=O)[O-] |
| InChIKey | BBFBBOXWQKGWPG-UHFFFAOYSA-N |
Chemical Property Profile of 2-Nitrophenyl (2-methylphenoxy)acetate
Property Insights of 2-Nitrophenyl (2-methylphenoxy)acetate
The XLogP value of 3.6 indicates that 2-Nitrophenyl (2-methylphenoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitrophenyl (2-methylphenoxy)acetate. Following Lipinski's Rule of Five, 2-Nitrophenyl (2-methylphenoxy)acetate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Nitrophenyl (2-methylphenoxy)acetate?
The CAS number of 2-Nitrophenyl (2-methylphenoxy)acetate is 118734-37-5.
What is the molecular formula of 2-Nitrophenyl (2-methylphenoxy)acetate?
The molecular formula of 2-Nitrophenyl (2-methylphenoxy)acetate is C15H13NO5.
What is the molecular weight of 2-Nitrophenyl (2-methylphenoxy)acetate?
The molecular weight of 2-Nitrophenyl (2-methylphenoxy)acetate is 287.07938 g/mol.
Where can I buy 2-Nitrophenyl (2-methylphenoxy)acetate?
You can request a quote for 2-Nitrophenyl (2-methylphenoxy)acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Nitrophenyl (2-methylphenoxy)acetate?
Yes, CoreyChem provides custom synthesis services for 2-Nitrophenyl (2-methylphenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.