4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene
TL;DR: 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene (CAS 1948-15-8) is a chemical compound with molecular formula C7H3ClF3NO3S and molecular weight 272.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene
Also Known As: [4-Chlor-2-nitro-phenyl]-trifluormethyl-sulfoxid|4-chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene
| Molecular Formula | C7H3ClF3NO3S |
|---|---|
| Molecular Weight | 272.95 g/mol |
| LogP | 2.8756 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.94742 |
| Heavy Atoms | 16 |
| Complexity | 462.68054 |
Chemical Identifiers
| CAS Number | 1948-15-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)[N+](=O)[O-])S(=O)C(F)(F)F |
Product Overview
4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene (CAS 1948-15-8), with molecular formula C7H3ClF3NO3S and molecular weight 272.95 g/mol. IUPAC: 4-chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene.
Chemical Property Profile of 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene
Property Insights of 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene
The XLogP value of 2.8756 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene. Following Lipinski's Rule of Five, 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene has 0 hydrogen bond donor(s) and 3 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-2-nitro-1-(trifluoromethylsulfinyl)benzene?
The CAS number of 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene is 1948-15-8.
What is the molecular formula of 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene?
The molecular formula of 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene is C7H3ClF3NO3S.
What is the molecular weight of 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene?
The molecular weight of 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene is 272.95 g/mol.
Where can I buy 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene?
You can request a quote for 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-nitro-1-(trifluoromethylsulfinyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.