tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride
TL;DR: tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride (CAS 1133-77-3) is a chemical compound with molecular formula C11H17Cl2PS and molecular weight 282.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl-chloro-methylsulfanyl-phenylphosphanium chloride
Also Known As: tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride, tert-butyl(chloro)(methylsulfanyl)(phenyl)phosphonium chloride, Chloro-methylsulfanyl-phenyl-tert-butyl-phosphanium Chloride, tert-butyl-chloro-methylsulfanyl-phenylphosphanium chloride, tert-butyl-chloro-methylsulfanyl-phenylphosphanium,chloride
| Molecular Formula | C11H17Cl2PS |
|---|---|
| Molecular Weight | 282.02 g/mol |
| LogP | 1.5638 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.01657 |
| Heavy Atoms | 15 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 1133-77-3 |
|---|---|
| SMILES | CC(C)(C)[P+](C1=CC=CC=C1)(SC)Cl.[Cl-] |
| InChIKey | IWWJJNMINFNUQE-UHFFFAOYSA-M |
Product Overview
tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride (CAS 1133-77-3), with molecular formula C11H17Cl2PS and molecular weight 282.02 g/mol. IUPAC: tert-butyl-chloro-methylsulfanyl-phenylphosphanium chloride.
Chemical Property Profile of tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride
Property Insights of tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride
The XLogP value of 1.5638 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride. With a topological polar surface area (TPSA) of 25.3 Ų, tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride has 0 hydrogen bond donor(s) and 2 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 tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride?
The CAS number of tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride is 1133-77-3.
What is the molecular formula of tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride?
The molecular formula of tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride is C11H17Cl2PS.
What is the molecular weight of tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride?
The molecular weight of tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride is 282.02 g/mol.
Where can I buy tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride?
You can request a quote for tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl-chloro-methylsulfanylphenylphosphanium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.