![1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene structure](/static/products/932/93213-73-1.png)
1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene
TL;DR: 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene (CAS 93213-73-1) is a chemical compound with molecular formula C14H13NO4S and molecular weight 291.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-(benzenesulfonyl)ethyl]-4-nitrobenzene
Also Known As: 1-[1-(benzenesulfonyl)ethyl]-4-nitrobenzene, 1-(4-nitrophenyl)ethyl phenyl sulfone, Phenyl(alpha-methyl-4-nitrobenzyl) sulfone, 1-nitro-4-[1-(phenylsulfonyl)ethyl]Benzene, J1.573.427B
| Molecular Formula | C14H13NO4S |
|---|---|
| Molecular Weight | 291.06 g/mol |
| LogP | 3.1297 |
| Topological Polar Surface Area | 77.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.05652 |
| Heavy Atoms | 20 |
| Complexity | 708.59894 |
Chemical Identifiers
| CAS Number | 93213-73-1 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)[N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2 |
Product Overview
1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene (CAS 93213-73-1), with molecular formula C14H13NO4S and molecular weight 291.06 g/mol. IUPAC: 1-[1-(benzenesulfonyl)ethyl]-4-nitrobenzene.
Chemical Property Profile of 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene
Property Insights of 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene
The XLogP value of 3.1297 indicates that 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene. Following Lipinski's Rule of Five, 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene 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-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene?
The CAS number of 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene is 93213-73-1.
What is the molecular formula of 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene?
The molecular formula of 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene is C14H13NO4S.
What is the molecular weight of 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene?
The molecular weight of 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene is 291.06 g/mol.
Where can I buy 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene?
You can request a quote for 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-[1-(Benzenesulfonyl)ethyl]-4-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.