Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate
TL;DR: Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate (CAS 23161-27-5) is a chemical compound with molecular formula C13H17NO5 and molecular weight 267.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-hydroxy-2-(phenylmethoxycarbonylamino)propanoate
Also Known As: ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate, Ethyl 3-hydroxy-2-phenylmethoxycarbonylamino-propanoate
| Molecular Formula | C13H17NO5 |
|---|---|
| Molecular Weight | 267.11 g/mol |
| LogP | 0.8368 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 267.1107 |
| Heavy Atoms | 19 |
| Complexity | 406.75443 |
Chemical Identifiers
| CAS Number | 23161-27-5 |
|---|---|
| SMILES | CCOC(=O)C(CO)NC(=O)OCC1=CC=CC=C1 |
Product Overview
Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate (CAS 23161-27-5), with molecular formula C13H17NO5 and molecular weight 267.11 g/mol. IUPAC: ethyl 3-hydroxy-2-(phenylmethoxycarbonylamino)propanoate.
Chemical Property Profile of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate
Property Insights of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate
The XLogP value of 0.8368 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate. Following Lipinski's Rule of Five, Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate has 2 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 Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate?
The CAS number of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate is 23161-27-5.
What is the molecular formula of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate?
The molecular formula of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate is C13H17NO5.
What is the molecular weight of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate?
The molecular weight of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate is 267.11 g/mol.
Where can I buy Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate?
You can request a quote for Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.