methyl N-(4-bromophenyl)glycinate
TL;DR: methyl N-(4-bromophenyl)glycinate (CAS 131770-56-4) is a chemical compound with molecular formula C9H10BrNO2 and molecular weight 242.98949 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-(4-bromoanilino)acetate
Also Known As: methyl N-(4-bromophenyl)glycinate, methyl 2-[(4-bromophenyl)amino]acetate, methyl 2-(4-bromoanilino)acetate, Methyl (4-bromophenyl)glycinate, N-(4-Bromophenyl)glycine methyl ester
Technical Specifications
| Molecular Formula | C9H10BrNO2 |
| Molecular Weight | 242.98949 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.98949 Da |
| Heavy Atoms | 13 |
| Complexity | 167.0 |
| SMILES | COC(=O)CNC1=CC=C(C=C1)Br |
| InChIKey | CTTJLLJXWHBYHW-UHFFFAOYSA-N |
Chemical Property Profile of methyl N-(4-bromophenyl)glycinate
Property Insights of methyl N-(4-bromophenyl)glycinate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-(4-bromophenyl)glycinate. With a topological polar surface area (TPSA) of 38.3 Ų, methyl N-(4-bromophenyl)glycinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl N-(4-bromophenyl)glycinate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of methyl N-(4-bromophenyl)glycinate?
The CAS number of methyl N-(4-bromophenyl)glycinate is 131770-56-4.
What is the molecular formula of methyl N-(4-bromophenyl)glycinate?
The molecular formula of methyl N-(4-bromophenyl)glycinate is C9H10BrNO2.
What is the molecular weight of methyl N-(4-bromophenyl)glycinate?
The molecular weight of methyl N-(4-bromophenyl)glycinate is 242.98949 g/mol.
Where can I buy methyl N-(4-bromophenyl)glycinate?
You can request a quote for methyl N-(4-bromophenyl)glycinate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl N-(4-bromophenyl)glycinate?
Yes, CoreyChem provides custom synthesis services for methyl N-(4-bromophenyl)glycinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.