4-Nitrophenyl(phenylselenyl)acetate
TL;DR: 4-Nitrophenyl(phenylselenyl)acetate (CAS 104015-14-7) is a chemical compound with molecular formula C14H11NO4Se and molecular weight 336.98532 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-nitrophenyl) 2-phenylselanylacetate
Also Known As: Nitrophenyl-Ph-selenyl-Ac, 4-Nitrophenyl(phenylselenyl)acetate, p-Nitrophenyl(phenylselenyl)acetate, (4-nitrophenyl) 2-phenylselanylacetate, 4-nitrophenyl (phenylselanyl)acetate
Technical Specifications
| Molecular Formula | C14H11NO4Se |
| Molecular Weight | 336.98532 g/mol |
| XLogP | 1.9482 |
| Topological Polar Surface Area (TPSA) | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.98532 Da |
| Heavy Atoms | 20 |
| Complexity | 331.0 |
| SMILES | C1=CC=C(C=C1)[Se]CC(=O)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | FLNINVYSBFZTTD-UHFFFAOYSA-N |
Chemical Property Profile of 4-Nitrophenyl(phenylselenyl)acetate
Property Insights of 4-Nitrophenyl(phenylselenyl)acetate
The XLogP value of 1.9482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitrophenyl(phenylselenyl)acetate. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitrophenyl(phenylselenyl)acetate. Following Lipinski's Rule of Five, 4-Nitrophenyl(phenylselenyl)acetate 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
What is the CAS number of 4-Nitrophenyl(phenylselenyl)acetate?
The CAS number of 4-Nitrophenyl(phenylselenyl)acetate is 104015-14-7.
What is the molecular formula of 4-Nitrophenyl(phenylselenyl)acetate?
The molecular formula of 4-Nitrophenyl(phenylselenyl)acetate is C14H11NO4Se.
What is the molecular weight of 4-Nitrophenyl(phenylselenyl)acetate?
The molecular weight of 4-Nitrophenyl(phenylselenyl)acetate is 336.98532 g/mol.
Where can I buy 4-Nitrophenyl(phenylselenyl)acetate?
You can request a quote for 4-Nitrophenyl(phenylselenyl)acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Nitrophenyl(phenylselenyl)acetate?
Yes, CoreyChem provides custom synthesis services for 4-Nitrophenyl(phenylselenyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.