4-Methylsulfonyl-2-nitro-1-phenoxybenzene
TL;DR: 4-Methylsulfonyl-2-nitro-1-phenoxybenzene (CAS 102309-64-8) is a chemical compound with molecular formula C13H11NO5S and molecular weight 293.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylsulfonyl-2-nitro-1-phenoxybenzene
Also Known As: 4-methylsulfonyl-2-nitro-1-phenoxybenzene, 4-(METHYLSULFONYL)-2-NITRO-1-PHENOXYBENZENE
| Molecular Formula | C13H11NO5S |
|---|---|
| Molecular Weight | 293.04 g/mol |
| LogP | 2.7906 |
| Topological Polar Surface Area | 86.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.0358 |
| Heavy Atoms | 20 |
| Complexity | 740.61176 |
Chemical Identifiers
| CAS Number | 102309-64-8 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=CC=C2)[N+](=O)[O-] |
Product Overview
4-Methylsulfonyl-2-nitro-1-phenoxybenzene (CAS 102309-64-8), with molecular formula C13H11NO5S and molecular weight 293.04 g/mol. IUPAC: 4-methylsulfonyl-2-nitro-1-phenoxybenzene.
Chemical Property Profile of 4-Methylsulfonyl-2-nitro-1-phenoxybenzene
Property Insights of 4-Methylsulfonyl-2-nitro-1-phenoxybenzene
The XLogP value of 2.7906 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methylsulfonyl-2-nitro-1-phenoxybenzene. The TPSA of 86.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methylsulfonyl-2-nitro-1-phenoxybenzene. Following Lipinski's Rule of Five, 4-Methylsulfonyl-2-nitro-1-phenoxybenzene 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
Frequently Asked Questions
What is the CAS number of 4-Methylsulfonyl-2-nitro-1-phenoxybenzene?
The CAS number of 4-Methylsulfonyl-2-nitro-1-phenoxybenzene is 102309-64-8.
What is the molecular formula of 4-Methylsulfonyl-2-nitro-1-phenoxybenzene?
The molecular formula of 4-Methylsulfonyl-2-nitro-1-phenoxybenzene is C13H11NO5S.
What is the molecular weight of 4-Methylsulfonyl-2-nitro-1-phenoxybenzene?
The molecular weight of 4-Methylsulfonyl-2-nitro-1-phenoxybenzene is 293.04 g/mol.
Where can I buy 4-Methylsulfonyl-2-nitro-1-phenoxybenzene?
You can request a quote for 4-Methylsulfonyl-2-nitro-1-phenoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylsulfonyl-2-nitro-1-phenoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylsulfonyl-2-nitro-1-phenoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.