![Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)- structure](/static/products/3263/32631-20-2.webp)
Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)-
TL;DR: Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)- (CAS 32631-20-2) is a chemical compound with molecular formula C13H7ClF3NO2S and molecular weight 332.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)sulfanyl-2-nitro-4-(trifluoromethyl)benzene
Also Known As: Maybridge1_004661, BAS 00245301, UPCMLD0ENAT0507-4336:001, KM 03010, Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)-
| Molecular Formula | C13H7ClF3NO2S |
|---|---|
| Molecular Weight | 332.98 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.98383 |
| Heavy Atoms | 21 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 32631-20-2 |
|---|---|
| SMILES | C1=CC(=CC=C1SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])Cl |
| InChIKey | ZUYDWYRPRVMBLC-UHFFFAOYSA-N |
Product Overview
Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)- (CAS 32631-20-2), with molecular formula C13H7ClF3NO2S and molecular weight 332.98 g/mol. IUPAC: 1-(4-chlorophenyl)sulfanyl-2-nitro-4-(trifluoromethyl)benzene.
Chemical Property Profile of Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)-
Property Insights of Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)-
The XLogP value of 4.8 indicates that Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)-. Following Lipinski's Rule of Five, Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)- has 0 hydrogen bond donor(s) and 6 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 Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)-?
The CAS number of Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)- is 32631-20-2.
What is the molecular formula of Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)-?
The molecular formula of Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)- is C13H7ClF3NO2S.
What is the molecular weight of Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)-?
The molecular weight of Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)- is 332.98 g/mol.
Where can I buy Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)-?
You can request a quote for Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-[(4-chlorophenyl)thio]-2-nitro-4-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.