Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]-
TL;DR: Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]- (CAS 89227-86-1) is a chemical compound with molecular formula C9H8Cl4OS and molecular weight 303.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trichloro-1-[(4-chlorophenyl)methylsulfanyl]ethanol
Also Known As: 2,2,2-trichloro-1-[(4-chlorophenyl)methylsulfanyl]ethanol, Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]-, 2,2,2-trichloro-1-[(4-chlorobenzyl)thio]ethanol, Ethanol,2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio], 2,2,2-Trichloro-1-{[(4-chlorophenyl)methyl]sulfanyl}ethan-1-ol
| Molecular Formula | C9H8Cl4OS |
|---|---|
| Molecular Weight | 303.90 g/mol |
| LogP | 4.2618 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 303.905 |
| Heavy Atoms | 15 |
| Complexity | 308.88354 |
Chemical Identifiers
| CAS Number | 89227-86-1 |
|---|---|
| SMILES | C1=CC(=CC=C1CSC(C(Cl)(Cl)Cl)O)Cl |
Product Overview
Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]- (CAS 89227-86-1), with molecular formula C9H8Cl4OS and molecular weight 303.90 g/mol. IUPAC: 2,2,2-trichloro-1-[(4-chlorophenyl)methylsulfanyl]ethanol.
Chemical Property Profile of Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]-
Property Insights of Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]-
The XLogP value of 4.2618 indicates that Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]- has 1 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 Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]-?
The CAS number of Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]- is 89227-86-1.
What is the molecular formula of Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]-?
The molecular formula of Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]- is C9H8Cl4OS.
What is the molecular weight of Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]-?
The molecular weight of Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]- is 303.90 g/mol.
Where can I buy Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]-?
You can request a quote for Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]-?
Yes, KEHONG BIO provides custom synthesis services for Ethanol, 2,2,2-trichloro-1-[[(4-chlorophenyl)methyl]thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.