2-(4-硝基苯甲酰基)氧基-3-苯基丙酸
TL;DR: 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸 (CAS 69056-26-4) is a chemical compound with molecular formula C16H13NO6 and molecular weight 315.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-硝基苯甲酰基)氧基-3-苯基丙酸
2-(4-nitrobenzoyl)oxy-3-phenylpropanoic acid
Also Known As: 2-(4-nitrobenzoyl)oxy-3-phenylpropanoic acid, 2-[(4-Nitrobenzoyl)oxy]-3-phenylpropanoic acid
| Molecular Formula | C16H13NO6 |
|---|---|
| Molecular Weight | 315.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 315.07428 |
| Heavy Atoms | 23 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 69056-26-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C(=O)O)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | FPLZNUBFSJRWDO-UHFFFAOYSA-N |
Product Overview
2-(4-硝基苯甲酰基)氧基-3-苯基丙酸 (CAS 69056-26-4), with molecular formula C16H13NO6 and molecular weight 315.07 g/mol. IUPAC: 2-(4-nitrobenzoyl)oxy-3-phenylpropanoic acid.
Chemical Property Profile of 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸
Property Insights of 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸
The XLogP value of 3.2 indicates that 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸. Following Lipinski's Rule of Five, 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸 has 1 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 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸?
The CAS number of 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸 is 69056-26-4.
What is the molecular formula of 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸?
The molecular formula of 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸 is C16H13NO6.
What is the molecular weight of 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸?
The molecular weight of 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸 is 315.07 g/mol.
Where can I buy 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸?
You can request a quote for 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-硝基苯甲酰基)氧基-3-苯基丙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.