4-Amino-5-(benzyloxy)-5-oxopentanoic acid
TL;DR: 4-Amino-5-(benzyloxy)-5-oxopentanoic acid (CAS 53661-98-6) is a chemical compound with molecular formula C12H15NO4 and molecular weight 237.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-5-oxo-5-phenylmethoxypentanoic acid
Also Known As: H-D-Glu-OBzl, H-Glu-OBzl, L-Glutamic Acid 1-Benzyl Ester, l-glutamic acid alpha-benzyl ester, L-Glutamic acid a-benzyl ester
| Molecular Formula | C12H15NO4 |
|---|---|
| Molecular Weight | 237.10 g/mol |
| LogP | -1.7 |
| Topological Polar Surface Area | 89.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 237.10011 |
| Heavy Atoms | 17 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 53661-98-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)C(CCC(=O)O)N |
| InChIKey | HFZKKJHBHCZXTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Amino-5-(benzyloxy)-5-oxopentanoic acid (CAS 53661-98-6), with molecular formula C12H15NO4 and molecular weight 237.10 g/mol. IUPAC: 4-amino-5-oxo-5-phenylmethoxypentanoic acid.
Chemical Property Profile of 4-Amino-5-(benzyloxy)-5-oxopentanoic acid
Property Insights of 4-Amino-5-(benzyloxy)-5-oxopentanoic acid
The XLogP value of -1.7 indicates that 4-Amino-5-(benzyloxy)-5-oxopentanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-5-(benzyloxy)-5-oxopentanoic acid. Following Lipinski's Rule of Five, 4-Amino-5-(benzyloxy)-5-oxopentanoic acid 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 4-Amino-5-(benzyloxy)-5-oxopentanoic acid?
The CAS number of 4-Amino-5-(benzyloxy)-5-oxopentanoic acid is 53661-98-6.
What is the molecular formula of 4-Amino-5-(benzyloxy)-5-oxopentanoic acid?
The molecular formula of 4-Amino-5-(benzyloxy)-5-oxopentanoic acid is C12H15NO4.
What is the molecular weight of 4-Amino-5-(benzyloxy)-5-oxopentanoic acid?
The molecular weight of 4-Amino-5-(benzyloxy)-5-oxopentanoic acid is 237.10 g/mol.
Where can I buy 4-Amino-5-(benzyloxy)-5-oxopentanoic acid?
You can request a quote for 4-Amino-5-(benzyloxy)-5-oxopentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-5-(benzyloxy)-5-oxopentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-5-(benzyloxy)-5-oxopentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.