![Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate structure](/static/products/6961/6961-56-4.webp)
Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate
TL;DR: Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate (CAS 6961-56-4) is a chemical compound with molecular formula C16H23NO5 and molecular weight 309.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-[(2-methoxy-5-methylphenyl)carbamoyloxy]propanoate
Also Known As: butyl2-[carbamoyloxy]propanoate, butyl2-[ carbamoyloxy]propanoate, butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate, butyl 2-[(2-methoxy-5-methylphenyl)carbamoyloxy]propanoate, Propanoic acid,2-[[[(2-methoxy-5-methylphenyl)amino]carbonyl]oxy]-, butyl ester
| Molecular Formula | C16H23NO5 |
|---|---|
| Molecular Weight | 309.16 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 73.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 309.15762 |
| Heavy Atoms | 22 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 6961-56-4 |
|---|---|
| SMILES | CCCCOC(=O)C(C)OC(=O)NC1=C(C=CC(=C1)C)OC |
| InChIKey | XLOXJEDAIUVMHD-UHFFFAOYSA-N |
Product Overview
Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate (CAS 6961-56-4), with molecular formula C16H23NO5 and molecular weight 309.16 g/mol. IUPAC: butyl 2-[(2-methoxy-5-methylphenyl)carbamoyloxy]propanoate.
Chemical Property Profile of Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate
Property Insights of Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate
The XLogP value of 3.4 indicates that Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate. Following Lipinski's Rule of Five, Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate 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
Frequently Asked Questions
What is the CAS number of Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate?
The CAS number of Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate is 6961-56-4.
What is the molecular formula of Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate?
The molecular formula of Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate is C16H23NO5.
What is the molecular weight of Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate?
The molecular weight of Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate is 309.16 g/mol.
Where can I buy Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate?
You can request a quote for Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 2-{[(2-methoxy-5-methylphenyl)carbamoyl]oxy}propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.