1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene
TL;DR: 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene (CAS 23023-08-7) is a chemical compound with molecular formula C12H15NO4 and molecular weight 237.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dimethoxy-4-(2-nitrobut-1-enyl)benzene
Also Known As: 1,2-dimethoxy-4-(2-nitrobut-1-enyl)benzene, 1,2-dimethoxy-4-[2-nitrobut-1-enyl]benzene, Benzene,1,2-dimethoxy-4-(2-nitro-1-buten-1-yl)-
| Molecular Formula | C12H15NO4 |
|---|---|
| Molecular Weight | 237.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 64.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.10011 |
| Heavy Atoms | 17 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 23023-08-7 |
|---|---|
| SMILES | CCC(=CC1=CC(=C(C=C1)OC)OC)[N+](=O)[O-] |
| InChIKey | NRBCNHBQBWHAJU-UHFFFAOYSA-N |
Product Overview
1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene (CAS 23023-08-7), with molecular formula C12H15NO4 and molecular weight 237.10 g/mol. IUPAC: 1,2-dimethoxy-4-(2-nitrobut-1-enyl)benzene.
Chemical Property Profile of 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene
Property Insights of 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene. Following Lipinski's Rule of Five, 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene has 0 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 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene?
The CAS number of 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene is 23023-08-7.
What is the molecular formula of 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene?
The molecular formula of 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene is C12H15NO4.
What is the molecular weight of 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene?
The molecular weight of 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene is 237.10 g/mol.
Where can I buy 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene?
You can request a quote for 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dimethoxy-4-[2-nitrobut-1-enyl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.