DL-苯丙氨酸甲酯
TL;DR: DL-苯丙氨酸甲酯 (CAS 15028-44-1) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
DL-苯丙氨酸甲酯
methyl 2-amino-3-phenylpropanoate
Also Known As: Methyl 2-amino-3-phenylpropanoate, Methyl l-phenylalaninate, H-DL-Phe-OMe HCl, Methyl phenylalaninate, DL-phenylalanine methyl ester
| Molecular Formula | C10H13NO2 |
|---|---|
| Molecular Weight | 179.09 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 179.09464 |
| Heavy Atoms | 13 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 15028-44-1 |
|---|---|
| SMILES | COC(=O)C(CC1=CC=CC=C1)N |
| InChIKey | VSDUZFOSJDMAFZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
DL-苯丙氨酸甲酯 (CAS 15028-44-1), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: methyl 2-amino-3-phenylpropanoate.
Chemical Property Profile of DL-苯丙氨酸甲酯
Property Insights of DL-苯丙氨酸甲酯
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DL-苯丙氨酸甲酯. With a topological polar surface area (TPSA) of 52.3 Ų, DL-苯丙氨酸甲酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, DL-苯丙氨酸甲酯 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 DL-苯丙氨酸甲酯?
The CAS number of DL-苯丙氨酸甲酯 is 15028-44-1.
What is the molecular formula of DL-苯丙氨酸甲酯?
The molecular formula of DL-苯丙氨酸甲酯 is C10H13NO2.
What is the molecular weight of DL-苯丙氨酸甲酯?
The molecular weight of DL-苯丙氨酸甲酯 is 179.09 g/mol.
Where can I buy DL-苯丙氨酸甲酯?
You can request a quote for DL-苯丙氨酸甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DL-苯丙氨酸甲酯?
Yes, KEHONG BIO provides custom synthesis services for DL-苯丙氨酸甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.