2-Methoxy-5-(2-nitrovinyl)phenol
TL;DR: 2-Methoxy-5-(2-nitrovinyl)phenol (CAS 176247-38-4) is a chemical compound with molecular formula C9H9NO4 and molecular weight 195.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-5-[(E)-2-nitroethenyl]phenol
Also Known As: 2-METHOXY-5-(2-NITROVINYL)PHENOL, Dopamine Impurity 2, 2-methoxy-5-(2-nitroethenyl)phenol, 2-methoxy-5-[(E)-2-nitroethenyl]phenol, 2-methoxy-5-[(1E)-2-nitroethenyl]phenol
| Molecular Formula | C9H9NO4 |
|---|---|
| Molecular Weight | 195.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.05316 |
| Heavy Atoms | 14 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 176247-38-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C/[N+](=O)[O-])O |
| InChIKey | QGCVJPGJBCRIEV-SNAWJCMRSA-N |
Product Overview
2-Methoxy-5-(2-nitrovinyl)phenol (CAS 176247-38-4), with molecular formula C9H9NO4 and molecular weight 195.05 g/mol. IUPAC: 2-methoxy-5-[(E)-2-nitroethenyl]phenol.
Chemical Property Profile of 2-Methoxy-5-(2-nitrovinyl)phenol
Property Insights of 2-Methoxy-5-(2-nitrovinyl)phenol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxy-5-(2-nitrovinyl)phenol. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methoxy-5-(2-nitrovinyl)phenol. Following Lipinski's Rule of Five, 2-Methoxy-5-(2-nitrovinyl)phenol 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 2-Methoxy-5-(2-nitrovinyl)phenol?
The CAS number of 2-Methoxy-5-(2-nitrovinyl)phenol is 176247-38-4.
What is the molecular formula of 2-Methoxy-5-(2-nitrovinyl)phenol?
The molecular formula of 2-Methoxy-5-(2-nitrovinyl)phenol is C9H9NO4.
What is the molecular weight of 2-Methoxy-5-(2-nitrovinyl)phenol?
The molecular weight of 2-Methoxy-5-(2-nitrovinyl)phenol is 195.05 g/mol.
Where can I buy 2-Methoxy-5-(2-nitrovinyl)phenol?
You can request a quote for 2-Methoxy-5-(2-nitrovinyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxy-5-(2-nitrovinyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-5-(2-nitrovinyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.