![4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate structure](/static/products/1257/125789-60-8.webp)
4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate
TL;DR: 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate (CAS 125789-60-8) is a chemical compound with molecular formula C13H15NO5 and molecular weight 265.09503 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(acetamidomethyl)-2-acetyloxyphenyl] acetate
Also Known As: 4-[(acetylamino)methyl]-2-(acetyloxy)phenyl acetate, [4-(acetamidomethyl)-2-acetyloxyphenyl] acetate
Technical Specifications
| Molecular Formula | C13H15NO5 |
| Molecular Weight | 265.09503 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 265.09503 Da |
| Heavy Atoms | 19 |
| Complexity | 355.0 |
| SMILES | CC(=O)NCC1=CC(=C(C=C1)OC(=O)C)OC(=O)C |
| InChIKey | KIYMCVJRHUWTHN-UHFFFAOYSA-N |
Chemical Property Profile of 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate
Property Insights of 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate. Following Lipinski's Rule of Five, 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate has 1 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 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate?
The CAS number of 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate is 125789-60-8.
What is the molecular formula of 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate?
The molecular formula of 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate is C13H15NO5.
What is the molecular weight of 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate?
The molecular weight of 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate is 265.09503 g/mol.
Where can I buy 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate?
You can request a quote for 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate?
Yes, CoreyChem provides custom synthesis services for 4-[(Acetylamino)methyl]-2-(acetyloxy)phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.