Methyl alpha,3-dimethyltyrosinate
TL;DR: Methyl alpha,3-dimethyltyrosinate (CAS 23365-29-9) is a chemical compound with molecular formula C12H17NO3 and molecular weight 223.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-amino-3-(4-hydroxy-3-methylphenyl)-2-methylpropanoate
Also Known As: Methyl alpha,3-dimethyltyrosinate, methyl2-amino-3- -2-methyl-propanoate, methyl 2-amino-3-(4-hydroxy-3-methylphenyl)-2-methylpropanoate, DL-Tyrosine,, A,3-dimethyl-, methyl ester, hydrochloride
| Molecular Formula | C12H17NO3 |
|---|---|
| Molecular Weight | 223.12 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 72.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 223.12085 |
| Heavy Atoms | 16 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 23365-29-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)CC(C)(C(=O)OC)N)O |
| InChIKey | IJHKPBBVCNYJME-UHFFFAOYSA-N |
Product Overview
Methyl alpha,3-dimethyltyrosinate (CAS 23365-29-9), with molecular formula C12H17NO3 and molecular weight 223.12 g/mol. IUPAC: methyl 2-amino-3-(4-hydroxy-3-methylphenyl)-2-methylpropanoate.
Chemical Property Profile of Methyl alpha,3-dimethyltyrosinate
Property Insights of Methyl alpha,3-dimethyltyrosinate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl alpha,3-dimethyltyrosinate. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl alpha,3-dimethyltyrosinate. Following Lipinski's Rule of Five, Methyl alpha,3-dimethyltyrosinate has 2 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 alpha,3-dimethyltyrosinate?
The CAS number of Methyl alpha,3-dimethyltyrosinate is 23365-29-9.
What is the molecular formula of Methyl alpha,3-dimethyltyrosinate?
The molecular formula of Methyl alpha,3-dimethyltyrosinate is C12H17NO3.
What is the molecular weight of Methyl alpha,3-dimethyltyrosinate?
The molecular weight of Methyl alpha,3-dimethyltyrosinate is 223.12 g/mol.
Where can I buy Methyl alpha,3-dimethyltyrosinate?
You can request a quote for Methyl alpha,3-dimethyltyrosinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl alpha,3-dimethyltyrosinate?
Yes, KEHONG BIO provides custom synthesis services for Methyl alpha,3-dimethyltyrosinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.