α-单氟甲基酪氨酸甲酯
TL;DR: α-单氟甲基酪氨酸甲酯 (CAS 85923-83-7) is a chemical compound with molecular formula C11H14FNO3 and molecular weight 227.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
α-单氟甲基酪氨酸甲酯
methyl (2S)-2-amino-2-(fluoromethyl)-3-(4-hydroxyphenyl)propanoate
Also Known As: AMFMTME, alpha-Monofluoromethyltyrosine methyl ester, Methyl alpha-fluoromethyl-4-tyrosine, methyl, A-(fluoromethyl)-l-tyrosinate
| Molecular Formula | C11H14FNO3 |
|---|---|
| Molecular Weight | 227.10 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 72.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 227.09576 |
| Heavy Atoms | 16 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 85923-83-7 |
|---|---|
| SMILES | COC(=O)[C@@](CC1=CC=C(C=C1)O)(CF)N |
| InChIKey | AAHSQPDAYLVAQN-LLVKDONJSA-N |
Product Overview
α-单氟甲基酪氨酸甲酯 (CAS 85923-83-7), with molecular formula C11H14FNO3 and molecular weight 227.10 g/mol. IUPAC: methyl (2S)-2-amino-2-(fluoromethyl)-3-(4-hydroxyphenyl)propanoate.
Chemical Property Profile of α-单氟甲基酪氨酸甲酯
Property Insights of α-单氟甲基酪氨酸甲酯
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for α-单氟甲基酪氨酸甲酯. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for α-单氟甲基酪氨酸甲酯. Following Lipinski's Rule of Five, α-单氟甲基酪氨酸甲酯 has 2 hydrogen bond donor(s) and 5 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 α-单氟甲基酪氨酸甲酯?
The CAS number of α-单氟甲基酪氨酸甲酯 is 85923-83-7.
What is the molecular formula of α-单氟甲基酪氨酸甲酯?
The molecular formula of α-单氟甲基酪氨酸甲酯 is C11H14FNO3.
What is the molecular weight of α-单氟甲基酪氨酸甲酯?
The molecular weight of α-单氟甲基酪氨酸甲酯 is 227.10 g/mol.
Where can I buy α-单氟甲基酪氨酸甲酯?
You can request a quote for α-单氟甲基酪氨酸甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for α-单氟甲基酪氨酸甲酯?
Yes, KEHONG BIO provides custom synthesis services for α-单氟甲基酪氨酸甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.