Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate
TL;DR: Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate (CAS 342043-53-2) is a chemical compound with molecular formula C12H13NO6 and molecular weight 267.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate
Also Known As: methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate, methyl 3-{5-nitro-2-methoxyphenoxy}-2-butenoate
| Molecular Formula | C12H13NO6 |
|---|---|
| Molecular Weight | 267.07 g/mol |
| LogP | 2.059 |
| Topological Polar Surface Area | 87.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 267.07428 |
| Heavy Atoms | 19 |
| Complexity | 522.9509 |
Chemical Identifiers
| CAS Number | 342043-53-2 |
|---|---|
| SMILES | CC(=CC(=O)OC)OC1=C(C=CC(=C1)[N+](=O)[O-])OC |
Product Overview
Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate (CAS 342043-53-2), with molecular formula C12H13NO6 and molecular weight 267.07 g/mol. IUPAC: methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate.
Chemical Property Profile of Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate
Property Insights of Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate
The XLogP value of 2.059 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate. The TPSA of 87.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate. Following Lipinski's Rule of Five, Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate has 0 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 Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate?
The CAS number of Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate is 342043-53-2.
What is the molecular formula of Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate?
The molecular formula of Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate is C12H13NO6.
What is the molecular weight of Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate?
The molecular weight of Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate is 267.07 g/mol.
Where can I buy Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate?
You can request a quote for Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(2-methoxy-5-nitrophenoxy)but-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.