Benzyl 5-amino-4-oxopentanoate
TL;DR: Benzyl 5-amino-4-oxopentanoate (CAS 163271-21-4) is a chemical compound with molecular formula C12H15NO3 and molecular weight 221.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 5-amino-4-oxopentanoate
Also Known As: benzyl 5-amino-4-oxopentanoate, benzyl 5-aminolevulinate, aminolevulinic-acid-benzyl-ester, Aminolevulinic acid benzyl ester, Benzyl 5-amino-4-oxo-pentanoate
| Molecular Formula | C12H15NO3 |
|---|---|
| Molecular Weight | 221.11 g/mol |
| LogP | 1.0378 |
| Topological Polar Surface Area | 69.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 221.1052 |
| Heavy Atoms | 16 |
| Complexity | 348.54132 |
Chemical Identifiers
| CAS Number | 163271-21-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)CCC(=O)CN |
Product Overview
Benzyl 5-amino-4-oxopentanoate (CAS 163271-21-4), with molecular formula C12H15NO3 and molecular weight 221.11 g/mol. IUPAC: benzyl 5-amino-4-oxopentanoate.
Chemical Property Profile of Benzyl 5-amino-4-oxopentanoate
Property Insights of Benzyl 5-amino-4-oxopentanoate
The XLogP value of 1.0378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl 5-amino-4-oxopentanoate. The TPSA of 69.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl 5-amino-4-oxopentanoate. Following Lipinski's Rule of Five, Benzyl 5-amino-4-oxopentanoate has 1 hydrogen bond donor(s) and 4 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 Benzyl 5-amino-4-oxopentanoate?
The CAS number of Benzyl 5-amino-4-oxopentanoate is 163271-21-4.
What is the molecular formula of Benzyl 5-amino-4-oxopentanoate?
The molecular formula of Benzyl 5-amino-4-oxopentanoate is C12H15NO3.
What is the molecular weight of Benzyl 5-amino-4-oxopentanoate?
The molecular weight of Benzyl 5-amino-4-oxopentanoate is 221.11 g/mol.
Where can I buy Benzyl 5-amino-4-oxopentanoate?
You can request a quote for Benzyl 5-amino-4-oxopentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 5-amino-4-oxopentanoate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 5-amino-4-oxopentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.