((2,3,4-Trichlorophenyl)thio)acetic acid
TL;DR: ((2,3,4-Trichlorophenyl)thio)acetic acid (CAS 7253-99-8) is a chemical compound with molecular formula C8H5Cl3O2S and molecular weight 269.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3,4-trichlorophenyl)sulfanylacetic acid
Also Known As: [ thio]aceticacid|((2,3,4-Trichlorophenyl)thio)acetic acid|EINECS 276-230-2|2-(2,3,4-trichlorophenyl)sulfanylacetic acid|[(2,3,4-trichlorophenyl)sulfanyl]acetic acid|KST-1A7870|2-((2,3,4-Trichlorophenyl)thio)acetic acid|2-[(2,3,4-Trichlorophenyl)thio]acetic acid|2-[(2,3,4-trichlorophenyl)sulfanyl]acetic acid|NCGC00332727-01|[(2,3,4-trichlorophenyl)thio]acetic acid|AB00084033-01|AB00084033-04|AS-871/10526049
| Molecular Formula | C8H5Cl3O2S |
|---|---|
| Molecular Weight | 269.91 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.9076 |
| Heavy Atoms | 14 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 7253-99-8 |
|---|---|
| SMILES | C1=CC(=C(C(=C1SCC(=O)O)Cl)Cl)Cl |
| InChIKey | WYGFOYJKRHDDBG-UHFFFAOYSA-N |
Product Overview
((2,3,4-Trichlorophenyl)thio)acetic acid (CAS 7253-99-8), with molecular formula C8H5Cl3O2S and molecular weight 269.91 g/mol. IUPAC: 2-(2,3,4-trichlorophenyl)sulfanylacetic acid.
Chemical Property Profile of ((2,3,4-Trichlorophenyl)thio)acetic acid
Property Insights of ((2,3,4-Trichlorophenyl)thio)acetic acid
The XLogP value of 3.9 indicates that ((2,3,4-Trichlorophenyl)thio)acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for ((2,3,4-Trichlorophenyl)thio)acetic acid. Following Lipinski's Rule of Five, ((2,3,4-Trichlorophenyl)thio)acetic acid has 1 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 ((2,3,4-Trichlorophenyl)thio)acetic acid?
The CAS number of ((2,3,4-Trichlorophenyl)thio)acetic acid is 7253-99-8.
What is the molecular formula of ((2,3,4-Trichlorophenyl)thio)acetic acid?
The molecular formula of ((2,3,4-Trichlorophenyl)thio)acetic acid is C8H5Cl3O2S.
What is the molecular weight of ((2,3,4-Trichlorophenyl)thio)acetic acid?
The molecular weight of ((2,3,4-Trichlorophenyl)thio)acetic acid is 269.91 g/mol.
Where can I buy ((2,3,4-Trichlorophenyl)thio)acetic acid?
You can request a quote for ((2,3,4-Trichlorophenyl)thio)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((2,3,4-Trichlorophenyl)thio)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for ((2,3,4-Trichlorophenyl)thio)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.