Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro-
TL;DR: Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro- (CAS 56916-62-2) is a chemical compound with molecular formula C10H7Cl4NO2S and molecular weight 344.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5,6-tetrachloro-4-propan-2-ylsulfonylbenzonitrile
Also Known As: Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro-, 2,3,5,6-tetrachloro-4-propan-2-ylsulfonylbenzonitrile, 4-((1-Methylethyl)sulfonyl)-2,3,5,6-tetrachlorobenzonitrile, Benzonitrile,4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro, 2,3,5,6-TETRACHLORO-4-(PROPANE-2-SULFONYL)BENZONITRILE
| Molecular Formula | C10H7Cl4NO2S |
|---|---|
| Molecular Weight | 344.90 g/mol |
| LogP | 4.35398 |
| Topological Polar Surface Area | 57.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 344.89517 |
| Heavy Atoms | 18 |
| Complexity | 617.81714 |
Chemical Identifiers
| CAS Number | 56916-62-2 |
|---|---|
| SMILES | CC(C)S(=O)(=O)C1=C(C(=C(C(=C1Cl)Cl)C#N)Cl)Cl |
Product Overview
Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro- (CAS 56916-62-2), with molecular formula C10H7Cl4NO2S and molecular weight 344.90 g/mol. IUPAC: 2,3,5,6-tetrachloro-4-propan-2-ylsulfonylbenzonitrile.
Chemical Property Profile of Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro-
Property Insights of Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro-
The XLogP value of 4.35398 indicates that Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.93 Ų, Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro- 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 Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro-?
The CAS number of Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro- is 56916-62-2.
What is the molecular formula of Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro-?
The molecular formula of Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro- is C10H7Cl4NO2S.
What is the molecular weight of Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro-?
The molecular weight of Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro- is 344.90 g/mol.
Where can I buy Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro-?
You can request a quote for Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro-?
Yes, KEHONG BIO provides custom synthesis services for Benzonitrile, 4-((1-methylethyl)sulfonyl)-2,3,5,6-tetrachloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.