Butyl 3-(phenylcarbamoyloxy)propanoate
TL;DR: Butyl 3-(phenylcarbamoyloxy)propanoate (CAS 74516-89-5) is a chemical compound with molecular formula C14H19NO4 and molecular weight 265.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 3-(phenylcarbamoyloxy)propanoate
Also Known As: NCIOpen2_002867, butyl 3-(phenylcarbamoyloxy)propanoate, butyl 3-[(phenylcarbamoyl)oxy]propanoate
| Molecular Formula | C14H19NO4 |
|---|---|
| Molecular Weight | 265.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 265.1314 |
| Heavy Atoms | 19 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 74516-89-5 |
|---|---|
| SMILES | CCCCOC(=O)CCOC(=O)NC1=CC=CC=C1 |
| InChIKey | OBSVALLNIAFUFE-UHFFFAOYSA-N |
Product Overview
Butyl 3-(phenylcarbamoyloxy)propanoate (CAS 74516-89-5), with molecular formula C14H19NO4 and molecular weight 265.13 g/mol. IUPAC: butyl 3-(phenylcarbamoyloxy)propanoate.
Chemical Property Profile of Butyl 3-(phenylcarbamoyloxy)propanoate
Property Insights of Butyl 3-(phenylcarbamoyloxy)propanoate
The XLogP value of 3.1 indicates that Butyl 3-(phenylcarbamoyloxy)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyl 3-(phenylcarbamoyloxy)propanoate. Following Lipinski's Rule of Five, Butyl 3-(phenylcarbamoyloxy)propanoate has 1 hydrogen bond donor(s) and 4 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 3-(phenylcarbamoyloxy)propanoate?
The CAS number of Butyl 3-(phenylcarbamoyloxy)propanoate is 74516-89-5.
What is the molecular formula of Butyl 3-(phenylcarbamoyloxy)propanoate?
The molecular formula of Butyl 3-(phenylcarbamoyloxy)propanoate is C14H19NO4.
What is the molecular weight of Butyl 3-(phenylcarbamoyloxy)propanoate?
The molecular weight of Butyl 3-(phenylcarbamoyloxy)propanoate is 265.13 g/mol.
Where can I buy Butyl 3-(phenylcarbamoyloxy)propanoate?
You can request a quote for Butyl 3-(phenylcarbamoyloxy)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 3-(phenylcarbamoyloxy)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 3-(phenylcarbamoyloxy)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.