(2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride
TL;DR: (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride (CAS 118123-23-2) is a chemical compound with molecular formula C11H15ClN2O5 and molecular weight 290.06696 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (2S)-2-amino-3-(4-hydroxy-3-nitrophenyl)propanoate;hydrochloride
Also Known As: 3-Nitro-L-tyrosine ethyl ester hydrochloride, Ethyl 3-nitro-L-tyrosinate HCl, 3-Nitro-l-tyrosine ethyl ester, HCl, H-3-NITRO-TYR-OET HCL, EINECS 266-466-4
Technical Specifications
| Molecular Formula | C11H15ClN2O5 |
| Molecular Weight | 290.06696 g/mol |
| XLogP | 1.1551 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 290.06696 Da |
| Heavy Atoms | 19 |
| Complexity | 304.0 |
| SMILES | CCOC(=O)[C@H](CC1=CC(=C(C=C1)O)[N+](=O)[O-])N.Cl |
| InChIKey | GITKQXFBNJTMRP-QRPNPIFTSA-N |
Chemical Property Profile of (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride
Property Insights of (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride
The XLogP value of 1.1551 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride. Following Lipinski's Rule of Five, (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride?
The CAS number of (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride is 118123-23-2.
What is the molecular formula of (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride?
The molecular formula of (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride is C11H15ClN2O5.
What is the molecular weight of (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride?
The molecular weight of (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride is 290.06696 g/mol.
Where can I buy (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride?
You can request a quote for (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride?
Yes, CoreyChem provides custom synthesis services for (2S)-2-Amino-3-(4-hydroxy-3-nitrophenyl)propionic acid ethyl ester hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.