alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid
TL;DR: alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid (CAS 139262-66-1) is a chemical compound with molecular formula C10H11NO4 and molecular weight 209.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-carbamoyloxy-2-phenylpropanoic acid
Also Known As: Cppa-3,2, 3-Carbamoyloxy-2-phenylpropionic acid, 3-Carbamoyl-2-phenylpropionic acid, 3-carbamoyloxy-2-phenylpropanoic acid, 3-(CARBAMOYLOXY)-2-PHENYLPROPANOIC ACID
| Molecular Formula | C10H11NO4 |
|---|---|
| Molecular Weight | 209.07 g/mol |
| LogP | 0.9501 |
| Topological Polar Surface Area | 89.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 209.0688 |
| Heavy Atoms | 15 |
| Complexity | 349.69983 |
Chemical Identifiers
| CAS Number | 139262-66-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(COC(=O)N)C(=O)O |
Product Overview
alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid (CAS 139262-66-1), with molecular formula C10H11NO4 and molecular weight 209.07 g/mol. IUPAC: 3-carbamoyloxy-2-phenylpropanoic acid.
Chemical Property Profile of alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid
Property Insights of alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid
The XLogP value of 0.9501 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid. The TPSA of 89.62 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid. Following Lipinski's Rule of Five, alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid has 2 hydrogen bond donor(s) and 3 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 alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid?
The CAS number of alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid is 139262-66-1.
What is the molecular formula of alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid?
The molecular formula of alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid is C10H11NO4.
What is the molecular weight of alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid?
The molecular weight of alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid is 209.07 g/mol.
Where can I buy alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid?
You can request a quote for alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid?
Yes, KEHONG BIO provides custom synthesis services for alpha-(((Aminocarbonyl)oxy)methyl)benzeneacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.