1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene
TL;DR: 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene (CAS 29907-72-0) 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.
1,4-dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene
Also Known As: 2,5-Ddns, 1,4-dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene, 1-(2,5-DIMETHOXY-4-METHYLPHENYL)-2-NITROPROPENE, Benzene, 1,4-dimethoxy-2-methyl-5-(2-nitro-1-propen-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 | 3 |
| Exact Mass | 237.10011 |
| Heavy Atoms | 17 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 29907-72-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1OC)C=C(C)[N+](=O)[O-])OC |
| InChIKey | UCHNBPYWHXIUPN-UHFFFAOYSA-N |
Product Overview
1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene (CAS 29907-72-0), with molecular formula C12H15NO4 and molecular weight 237.10 g/mol. IUPAC: 1,4-dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene.
Chemical Property Profile of 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene
Property Insights of 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene. Following Lipinski's Rule of Five, 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-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 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene?
The CAS number of 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene is 29907-72-0.
What is the molecular formula of 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene?
The molecular formula of 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene is C12H15NO4.
What is the molecular weight of 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene?
The molecular weight of 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene is 237.10 g/mol.
Where can I buy 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene?
You can request a quote for 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-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 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dimethoxy-2-methyl-5-(2-nitroprop-1-enyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.