4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone
TL;DR: 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone (CAS 915764-02-2) is a chemical compound with molecular formula C12H7ClFNO4S and molecular weight 314.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-(4-fluorophenyl)sulfonyl-2-nitrobenzene
Also Known As: 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone, 1-chloro-4-(4-fluorophenyl)sulfonyl-2-nitrobenzene, 1-chloro-4-(4-fluorophenylsulfonyl)-2-nitrobenzene, Benzene, 1-chloro-4-[(4-fluorophenyl)sulfonyl]-2-nitro-, 1-Chloro-4-[(4-fluorophenyl)sulfonyl]-2-nitrobenzene #
| Molecular Formula | C12H7ClFNO4S |
|---|---|
| Molecular Weight | 314.98 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 88.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.97684 |
| Heavy Atoms | 20 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 915764-02-2 |
|---|---|
| SMILES | C1=CC(=CC=C1F)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-] |
| InChIKey | LQLSVBRNFBNHBC-UHFFFAOYSA-N |
Product Overview
4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone (CAS 915764-02-2), with molecular formula C12H7ClFNO4S and molecular weight 314.98 g/mol. IUPAC: 1-chloro-4-(4-fluorophenyl)sulfonyl-2-nitrobenzene.
Chemical Property Profile of 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone
Property Insights of 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone
The XLogP value of 3.2 indicates that 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone. Following Lipinski's Rule of Five, 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone 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-Chloro-3-nitrophenyl 4-fluorophenyl sulfone?
The CAS number of 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone is 915764-02-2.
What is the molecular formula of 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone?
The molecular formula of 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone is C12H7ClFNO4S.
What is the molecular weight of 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone?
The molecular weight of 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone is 314.98 g/mol.
Where can I buy 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone?
You can request a quote for 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3-nitrophenyl 4-fluorophenyl sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.