5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene
TL;DR: 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene (CAS 103796-15-2) is a chemical compound with molecular formula C11H13NO3 and molecular weight 207.08954 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene
Also Known As: 5-methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene, 5-METHOXY-1,3-DIMETHYL-2-(2-NITRO-VINYL)-BENZENE
Technical Specifications
| Molecular Formula | C11H13NO3 |
| Molecular Weight | 207.08954 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.08954 Da |
| Heavy Atoms | 15 |
| Complexity | 235.0 |
| SMILES | CC1=CC(=CC(=C1C=C[N+](=O)[O-])C)OC |
| InChIKey | KCLAPPJDHCXORZ-UHFFFAOYSA-N |
Chemical Property Profile of 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene
Property Insights of 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene. With a topological polar surface area (TPSA) of 55.1 Ų, 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene?
The CAS number of 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene is 103796-15-2.
What is the molecular formula of 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene?
The molecular formula of 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene is C11H13NO3.
What is the molecular weight of 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene?
The molecular weight of 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene is 207.08954 g/mol.
Where can I buy 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene?
You can request a quote for 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene?
Yes, CoreyChem provides custom synthesis services for 5-Methoxy-1,3-dimethyl-2-(2-nitroethenyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.