![2-[(Trifluoromethyl)sulfanyl]acetic acid structure](/static/products/2408/2408-17-5.webp)
2-[(Trifluoromethyl)sulfanyl]acetic acid
TL;DR: 2-[(Trifluoromethyl)sulfanyl]acetic acid (CAS 2408-17-5) is a chemical compound with molecular formula C3H3F3O2S and molecular weight 159.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(trifluoromethylsulfanyl)acetic acid
Also Known As: [(trifluoromethyl)thio]acetic acid|2-((Trifluoromethyl)thio)acetic acid|2-(trifluoromethylsulfanyl)acetic Acid|trifluoromethylthioacetic acid|Trifluoromethylsulfanyl-acetic acid|(trifluoromethyl)thioacetic acid|(Trifluoromethylthio)acetic acid|[(trifluoromethyl)sulfanyl]acetic acid|2-[(trifluoromethyl)sulfanyl]acetic acid|trifluoromethylmercaptoacetic acid|acetic acid, trifluoromethylthio-|2-(trifluoromethylthio)acetic acid|Acetic acid, [(trifluoromethyl)thio]-|2-((Trifluoromethyl)thio)aceticacid|2-[(Trifluoromethyl)thio]acetic Acid|2-((trifluoromethyl)sulfanyl)acetic acid|827-983-6|RefChem:450168|MFCD01050155|CDXSCTQQQWTJNJ-UHFFFAOYSA-N
| Molecular Formula | C3H3F3O2S |
|---|---|
| Molecular Weight | 159.98 g/mol |
| LogP | 1.324 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 159.98059 |
| Heavy Atoms | 9 |
| Complexity | 110.115715 |
Chemical Identifiers
| CAS Number | 2408-17-5 |
|---|---|
| SMILES | C(C(=O)O)SC(F)(F)F |
Product Overview
2-[(Trifluoromethyl)sulfanyl]acetic acid (CAS 2408-17-5), with molecular formula C3H3F3O2S and molecular weight 159.98 g/mol. IUPAC: 2-(trifluoromethylsulfanyl)acetic acid.
Chemical Property Profile of 2-[(Trifluoromethyl)sulfanyl]acetic acid
Property Insights of 2-[(Trifluoromethyl)sulfanyl]acetic acid
The XLogP value of 1.324 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(Trifluoromethyl)sulfanyl]acetic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-[(Trifluoromethyl)sulfanyl]acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(Trifluoromethyl)sulfanyl]acetic acid 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 2-[(Trifluoromethyl)sulfanyl]acetic acid?
The CAS number of 2-[(Trifluoromethyl)sulfanyl]acetic acid is 2408-17-5.
What is the molecular formula of 2-[(Trifluoromethyl)sulfanyl]acetic acid?
The molecular formula of 2-[(Trifluoromethyl)sulfanyl]acetic acid is C3H3F3O2S.
What is the molecular weight of 2-[(Trifluoromethyl)sulfanyl]acetic acid?
The molecular weight of 2-[(Trifluoromethyl)sulfanyl]acetic acid is 159.98 g/mol.
Where can I buy 2-[(Trifluoromethyl)sulfanyl]acetic acid?
You can request a quote for 2-[(Trifluoromethyl)sulfanyl]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-[(Trifluoromethyl)sulfanyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Trifluoromethyl)sulfanyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.