DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride
TL;DR: DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride (CAS 116366-24-6) is a chemical compound with molecular formula C12H17ClN2O5 and molecular weight 304.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2S)-2-amino-3-(4-methoxy-3-nitrophenyl)propanoate;hydrochloride
Also Known As: 4-Methoxy-5-nitro-DL-alanine ethyl ester hydrochloride, DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride, O-Methyl-3-nitro-DL-tyrosine ethyl ester monohydrochloride, Ethyl O-methyl-3-nitro-L-tyrosinate--hydrogen chloride (1/1), ethyl (2S)-2-amino-3-(4-methoxy-3-nitrophenyl)propanoate hydrochloride
| Molecular Formula | C12H17ClN2O5 |
|---|---|
| Molecular Weight | 304.08 g/mol |
| LogP | 1.4581 |
| Topological Polar Surface Area | 104.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 304.0826 |
| Heavy Atoms | 20 |
| Complexity | 480.91553 |
Chemical Identifiers
| CAS Number | 116366-24-6 |
|---|---|
| SMILES | CCOC(=O)[C@H](CC1=CC(=C(C=C1)OC)[N+](=O)[O-])N.Cl |
Product Overview
DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride (CAS 116366-24-6), with molecular formula C12H17ClN2O5 and molecular weight 304.08 g/mol. IUPAC: ethyl (2S)-2-amino-3-(4-methoxy-3-nitrophenyl)propanoate;hydrochloride.
Chemical Property Profile of DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride
Property Insights of DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride
The XLogP value of 1.4581 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride. The TPSA of 104.69 Ų falls within the moderate polarity range, balancing permeability and solubility for DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride. Following Lipinski's Rule of Five, DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride has 1 hydrogen bond donor(s) and 6 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-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride?
The CAS number of DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride is 116366-24-6.
What is the molecular formula of DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride?
The molecular formula of DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride is C12H17ClN2O5.
What is the molecular weight of DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride?
The molecular weight of DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride is 304.08 g/mol.
Where can I buy DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride?
You can request a quote for DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for DL-Tyrosine, O-methyl-3-nitro-, ethyl ester, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.