5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸
TL;DR: 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸 (CAS 13406-65-0) is a chemical compound with molecular formula C12H15NO5 and molecular weight 253.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸
5-(2-amino-2-carboxyethyl)-2-ethoxybenzoic acid
Also Known As: 3-carboxy-o-ethyltyrosine, DL-3-(3-Carboxy-4-ethoxyphenyl)alanine, 5-(2-amino-2-carboxy-ethyl)-2-ethoxy-benzoic Acid, 5-(2-amino-3-hydroxy-3-oxopropyl)-2-ethoxybenzoic acid
| Molecular Formula | C12H15NO5 |
|---|---|
| Molecular Weight | 253.10 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 253.09502 |
| Heavy Atoms | 18 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 13406-65-0 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)CC(C(=O)O)N)C(=O)O |
| InChIKey | HMFQUHJZRXADEZ-UHFFFAOYSA-N |
Product Overview
5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸 (CAS 13406-65-0), with molecular formula C12H15NO5 and molecular weight 253.10 g/mol. IUPAC: 5-(2-amino-2-carboxyethyl)-2-ethoxybenzoic acid.
Chemical Property Profile of 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸
Property Insights of 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸
The XLogP value of -1.5 indicates that 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸. Following Lipinski's Rule of Five, 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸 has 3 hydrogen bond donor(s) and 6 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 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸?
The CAS number of 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸 is 13406-65-0.
What is the molecular formula of 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸?
The molecular formula of 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸 is C12H15NO5.
What is the molecular weight of 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸?
The molecular weight of 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸 is 253.10 g/mol.
Where can I buy 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸?
You can request a quote for 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-氨基-2-羧乙基)-2-乙氧基苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.