![methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate structure](/static/products/143/143484-14-4.webp)
methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate
TL;DR: methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate (CAS 143484-14-4) is a chemical compound with molecular formula C12H14N2O4 and molecular weight 250.09535 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate
Also Known As: Methyl (E)-3-(2-(dimethylamino)vinyl)-4-nitrobenzoate, methyl 3-[2-(dimethylamino)ethenyl]-4-nitrobenzoate, methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate, methyl 3-(2-(dimethylamino)vinyl)-4-nitrobenzoate, 1Y-0802
Technical Specifications
| Molecular Formula | C12H14N2O4 |
| Molecular Weight | 250.09535 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 75.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 250.09535 Da |
| Heavy Atoms | 18 |
| Complexity | 335.0 |
| SMILES | CN(C)/C=C/C1=C(C=CC(=C1)C(=O)OC)[N+](=O)[O-] |
| InChIKey | YNJPBYXXPDXCRM-VOTSOKGWSA-N |
Chemical Property Profile of methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate
Property Insights of methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate. Following Lipinski's Rule of Five, methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate?
The CAS number of methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate is 143484-14-4.
What is the molecular formula of methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate?
The molecular formula of methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate is C12H14N2O4.
What is the molecular weight of methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate?
The molecular weight of methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate is 250.09535 g/mol.
Where can I buy methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate?
You can request a quote for methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate?
Yes, CoreyChem provides custom synthesis services for methyl 3-[(E)-2-(dimethylamino)ethenyl]-4-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.