丙氨酸丁酯
TL;DR: 丙氨酸丁酯 (CAS 2885-02-1) is a chemical compound with molecular formula C7H15NO2 and molecular weight 145.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丙氨酸丁酯
butyl (2R)-2-aminopropanoate
Also Known As: Alanine, butyl ester, (S)-Butyl 2-aminopropanoate, (R)-Butyl 2-aminopropanoate, butyl (2R)-2-aminopropanoate
| Molecular Formula | C7H15NO2 |
|---|---|
| Molecular Weight | 145.11 g/mol |
| LogP | 0.6769 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 145.11028 |
| Heavy Atoms | 10 |
| Complexity | 101.77923 |
Chemical Identifiers
| CAS Number | 2885-02-1 |
|---|---|
| SMILES | CCCCOC(=O)[C@@H](C)N |
Product Overview
丙氨酸丁酯 (CAS 2885-02-1), with molecular formula C7H15NO2 and molecular weight 145.11 g/mol. IUPAC: butyl (2R)-2-aminopropanoate.
Chemical Property Profile of 丙氨酸丁酯
Property Insights of 丙氨酸丁酯
The XLogP value of 0.6769 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丙氨酸丁酯. With a topological polar surface area (TPSA) of 52.32 Ų, 丙氨酸丁酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丙氨酸丁酯 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 丙氨酸丁酯?
The CAS number of 丙氨酸丁酯 is 2885-02-1.
What is the molecular formula of 丙氨酸丁酯?
The molecular formula of 丙氨酸丁酯 is C7H15NO2.
What is the molecular weight of 丙氨酸丁酯?
The molecular weight of 丙氨酸丁酯 is 145.11 g/mol.
Where can I buy 丙氨酸丁酯?
You can request a quote for 丙氨酸丁酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丙氨酸丁酯?
Yes, KEHONG BIO provides custom synthesis services for 丙氨酸丁酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.