3-Nitrophenyl (4-chlorophenoxy)acetate
TL;DR: 3-Nitrophenyl (4-chlorophenoxy)acetate (CAS 70907-27-6) is a chemical compound with molecular formula C14H10ClNO5 and molecular weight 307.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-nitrophenyl) 2-(4-chlorophenoxy)acetate
Also Known As: 3-nitrophenyl (4-chlorophenoxy)acetate, (3-nitrophenyl) 2-(4-chlorophenoxy)acetate, 3-nitrophenyl 2-(4-chlorophenoxy)acetate, AN-329/40887463
| Molecular Formula | C14H10ClNO5 |
|---|---|
| Molecular Weight | 307.02 g/mol |
| LogP | 3.2326 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.02475 |
| Heavy Atoms | 21 |
| Complexity | 656.6689 |
Chemical Identifiers
| CAS Number | 70907-27-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC(=O)COC2=CC=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
3-Nitrophenyl (4-chlorophenoxy)acetate (CAS 70907-27-6), with molecular formula C14H10ClNO5 and molecular weight 307.02 g/mol. IUPAC: (3-nitrophenyl) 2-(4-chlorophenoxy)acetate.
Chemical Property Profile of 3-Nitrophenyl (4-chlorophenoxy)acetate
Property Insights of 3-Nitrophenyl (4-chlorophenoxy)acetate
The XLogP value of 3.2326 indicates that 3-Nitrophenyl (4-chlorophenoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitrophenyl (4-chlorophenoxy)acetate. Following Lipinski's Rule of Five, 3-Nitrophenyl (4-chlorophenoxy)acetate has 0 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 3-Nitrophenyl (4-chlorophenoxy)acetate?
The CAS number of 3-Nitrophenyl (4-chlorophenoxy)acetate is 70907-27-6.
What is the molecular formula of 3-Nitrophenyl (4-chlorophenoxy)acetate?
The molecular formula of 3-Nitrophenyl (4-chlorophenoxy)acetate is C14H10ClNO5.
What is the molecular weight of 3-Nitrophenyl (4-chlorophenoxy)acetate?
The molecular weight of 3-Nitrophenyl (4-chlorophenoxy)acetate is 307.02 g/mol.
Where can I buy 3-Nitrophenyl (4-chlorophenoxy)acetate?
You can request a quote for 3-Nitrophenyl (4-chlorophenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitrophenyl (4-chlorophenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitrophenyl (4-chlorophenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.