Β-丙氨酸乙酯
TL;DR: Β-丙氨酸乙酯 (CAS 924-73-2) is a chemical compound with molecular formula C5H11NO2 and molecular weight 117.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Β-丙氨酸乙酯
ethyl 3-aminopropanoate
Also Known As: Ethyl 3-aminopropanoate, Beta-alanine ethyl ester, Ethyl beta-alanate, ethyl b-alaninate, ethyl beta-alaninate
| Molecular Formula | C5H11NO2 |
|---|---|
| Molecular Weight | 117.08 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 117.07898 |
| Heavy Atoms | 8 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 924-73-2 |
|---|---|
| SMILES | CCOC(=O)CCN |
| InChIKey | GSQBIOQCECCMOQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Β-丙氨酸乙酯 (CAS 924-73-2), with molecular formula C5H11NO2 and molecular weight 117.08 g/mol. IUPAC: ethyl 3-aminopropanoate.
Chemical Property Profile of Β-丙氨酸乙酯
Property Insights of Β-丙氨酸乙酯
The XLogP value of -0.5 indicates that Β-丙氨酸乙酯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.3 Ų, Β-丙氨酸乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Β-丙氨酸乙酯 has 1 hydrogen bond donor(s) and 3 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 Β-丙氨酸乙酯?
The CAS number of Β-丙氨酸乙酯 is 924-73-2.
What is the molecular formula of Β-丙氨酸乙酯?
The molecular formula of Β-丙氨酸乙酯 is C5H11NO2.
What is the molecular weight of Β-丙氨酸乙酯?
The molecular weight of Β-丙氨酸乙酯 is 117.08 g/mol.
Where can I buy Β-丙氨酸乙酯?
You can request a quote for Β-丙氨酸乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Β-丙氨酸乙酯?
Yes, KEHONG BIO provides custom synthesis services for Β-丙氨酸乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.