2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate
TL;DR: 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate (CAS 293765-22-7) is a chemical compound with molecular formula C16H15NO6 and molecular weight 317.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hydroxy-3-phenoxypropyl) 4-nitrobenzoate
Also Known As: 2-hydroxy-3-phenoxypropyl 4-nitrobenzoate, (2-hydroxy-3-phenoxypropyl) 4-nitrobenzoate
| Molecular Formula | C16H15NO6 |
|---|---|
| Molecular Weight | 317.09 g/mol |
| LogP | 2.1915 |
| Topological Polar Surface Area | 98.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 317.08994 |
| Heavy Atoms | 23 |
| Complexity | 656.0305 |
Chemical Identifiers
| CAS Number | 293765-22-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCC(COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])O |
Product Overview
2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate (CAS 293765-22-7), with molecular formula C16H15NO6 and molecular weight 317.09 g/mol. IUPAC: (2-hydroxy-3-phenoxypropyl) 4-nitrobenzoate.
Chemical Property Profile of 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate
Property Insights of 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate
The XLogP value of 2.1915 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate. The TPSA of 98.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate. Following Lipinski's Rule of Five, 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate 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-Hydroxy-3-phenoxypropyl 4-nitrobenzoate?
The CAS number of 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate is 293765-22-7.
What is the molecular formula of 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate?
The molecular formula of 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate is C16H15NO6.
What is the molecular weight of 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate?
The molecular weight of 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate is 317.09 g/mol.
Where can I buy 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate?
You can request a quote for 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-3-phenoxypropyl 4-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.