Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride
TL;DR: Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride (CAS 13265-01-5) is a chemical compound with molecular formula C12H18ClNO3 and molecular weight 259.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-amino-3-(4-hydroxy-3-methylphenyl)-2-methylpropanoate;hydrochloride
Also Known As: alpha,3-Dimethyltyrosine methyl ester hydrochloride, Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride, Tyrosine, .alpha.,3-dimethyl-, methyl ester, hydrochloride, Methyl alpha,3-dimethyl-L-tyrosinate--hydrogen chloride (1/1), (S)-Methyl 2-amino-3-(4-hydroxy-3-methylphenyl)-2-methylpropanoate hydrochloride
| Molecular Formula | C12H18ClNO3 |
|---|---|
| Molecular Weight | 259.10 g/mol |
| LogP | 1.55532 |
| Topological Polar Surface Area | 72.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.09753 |
| Heavy Atoms | 17 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 13265-01-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C[C@@](C)(C(=O)OC)N)O.Cl |
| InChIKey | ZWBVPAVQVBYURF-YDALLXLXSA-N |
Product Overview
Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride (CAS 13265-01-5), with molecular formula C12H18ClNO3 and molecular weight 259.10 g/mol. IUPAC: methyl (2S)-2-amino-3-(4-hydroxy-3-methylphenyl)-2-methylpropanoate;hydrochloride.
Chemical Property Profile of Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride
Property Insights of Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride
The XLogP value of 1.55532 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride. Following Lipinski's Rule of Five, Tyrosine, alpha,3-dimethyl-, methyl ester, 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 Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride?
The CAS number of Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride is 13265-01-5.
What is the molecular formula of Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride?
The molecular formula of Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride is C12H18ClNO3.
What is the molecular weight of Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride?
The molecular weight of Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride is 259.10 g/mol.
Where can I buy Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride?
You can request a quote for Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Tyrosine, alpha,3-dimethyl-, methyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.