![[4-(Trifluoromethyl)phenyl]methanesulfonyl chloride structure](/static/products/1271/127162-96-3.webp)
[4-(Trifluoromethyl)phenyl]methanesulfonyl chloride
TL;DR: [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride (CAS 127162-96-3) is a chemical compound with molecular formula C8H6ClF3O2S and molecular weight 257.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(trifluoromethyl)phenyl]methanesulfonyl chloride
Also Known As: [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride|4-(trifluoromethyl)benzylsulfonyl chloride|4-Trifluoromethylbenzylsulfonyl chloride|(4-(Trifluoromethyl)phenyl)methanesulfonyl chloride|ACMC-1CAB4|BZS-Q07-0|KS-00000ZGJ|KS-000022RL|Benzenemethanesulfonyl chloride, 4-(trifluoromethyl)-|AR2936|3-Cyano propionaldehyde dimethyl acetal|AS-7056|CS-W003925|(4-trifluoromethylphenyl)methanesulfonyl chloride|4-[(Chlorosulphonyl)methyl]benzotrifluoride|(4-Trifluoromethyl-phenyl)-methanesulfonyl chloride|4-trifluoromethyl-alpha-toluenesulfonyl chloride|L-2603|4-(Trifluoromethyl)benzylsulfonyl chloride, 97%|chloro{[4-(trifluoromethyl)phenyl]methyl}sulfone|(4-(Trifluoromethyl)phenyl)methanesulfonylchloride|[4-(Trifluoromethyl)phenyl]methanesulfonylchloride
| Molecular Formula | C8H6ClF3O2S |
|---|---|
| Molecular Weight | 257.97 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.9729 |
| Heavy Atoms | 15 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 127162-96-3 |
|---|---|
| SMILES | C1=CC(=CC=C1CS(=O)(=O)Cl)C(F)(F)F |
| InChIKey | KKBNUPMMAGEQAT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[4-(Trifluoromethyl)phenyl]methanesulfonyl chloride (CAS 127162-96-3), with molecular formula C8H6ClF3O2S and molecular weight 257.97 g/mol. IUPAC: [4-(trifluoromethyl)phenyl]methanesulfonyl chloride.
Chemical Property Profile of [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride
Property Insights of [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride. With a topological polar surface area (TPSA) of 42.5 Ų, [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride 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-(Trifluoromethyl)phenyl]methanesulfonyl chloride?
The CAS number of [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride is 127162-96-3.
What is the molecular formula of [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride?
The molecular formula of [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride is C8H6ClF3O2S.
What is the molecular weight of [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride?
The molecular weight of [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride is 257.97 g/mol.
Where can I buy [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride?
You can request a quote for [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for [4-(Trifluoromethyl)phenyl]methanesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.