Methyl tyrosinate hydrochloride
TL;DR: Methyl tyrosinate hydrochloride (CAS 3417-91-2) is a chemical compound with molecular formula C10H14ClNO3 and molecular weight 231.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-amino-3-(4-hydroxyphenyl)propanoate;hydrochloride
Also Known As: H-Tyr-OMe.HCl, L-Tyrosine methyl ester hydrochloride, Methyl L-tyrosinate hydrochloride, H-Tyr-Ome HCl, h-d-tyr-ome.hcl
| Molecular Formula | C10H14ClNO3 |
|---|---|
| Molecular Weight | 231.07 g/mol |
| LogP | 0.86 |
| Topological Polar Surface Area | 72.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.06622 |
| Heavy Atoms | 15 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 3417-91-2 |
|---|---|
| SMILES | COC(=O)[C@H](CC1=CC=C(C=C1)O)N.Cl |
| InChIKey | VXYFARNRGZWHTJ-FVGYRXGTSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl tyrosinate hydrochloride (CAS 3417-91-2), with molecular formula C10H14ClNO3 and molecular weight 231.07 g/mol. IUPAC: methyl (2S)-2-amino-3-(4-hydroxyphenyl)propanoate;hydrochloride.
Chemical Property Profile of Methyl tyrosinate hydrochloride
Property Insights of Methyl tyrosinate hydrochloride
The XLogP value of 0.86 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl tyrosinate hydrochloride. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl tyrosinate hydrochloride. Following Lipinski's Rule of Five, Methyl tyrosinate hydrochloride has 3 hydrogen bond donor(s) and 4 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 Methyl tyrosinate hydrochloride?
The CAS number of Methyl tyrosinate hydrochloride is 3417-91-2.
What is the molecular formula of Methyl tyrosinate hydrochloride?
The molecular formula of Methyl tyrosinate hydrochloride is C10H14ClNO3.
What is the molecular weight of Methyl tyrosinate hydrochloride?
The molecular weight of Methyl tyrosinate hydrochloride is 231.07 g/mol.
Where can I buy Methyl tyrosinate hydrochloride?
You can request a quote for Methyl tyrosinate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl tyrosinate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Methyl tyrosinate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.