(tert-Butylthio)acetic acid
TL;DR: (tert-Butylthio)acetic acid (CAS 24310-22-3) is a chemical compound with molecular formula C6H12O2S and molecular weight 148.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butylsulfanylacetic acid
Also Known As: (tert-Butylthio)acetic acid, 2-tert-butylsulfanylacetic acid, (tert-Butylsulfanyl)acetic acid, 2-(tert-butylsulfanyl)acetic acid, [(1,1-dimethylethyl)thio]aceticacid
| Molecular Formula | C6H12O2S |
|---|---|
| Molecular Weight | 148.06 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 148.0558 |
| Heavy Atoms | 9 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 24310-22-3 |
|---|---|
| SMILES | CC(C)(C)SCC(=O)O |
| InChIKey | JXOAXKCHGMRTGL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(tert-Butylthio)acetic acid (CAS 24310-22-3), with molecular formula C6H12O2S and molecular weight 148.06 g/mol. IUPAC: 2-tert-butylsulfanylacetic acid.
Chemical Property Profile of (tert-Butylthio)acetic acid
Property Insights of (tert-Butylthio)acetic acid
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (tert-Butylthio)acetic acid. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (tert-Butylthio)acetic acid. Following Lipinski's Rule of Five, (tert-Butylthio)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 (tert-Butylthio)acetic acid?
The CAS number of (tert-Butylthio)acetic acid is 24310-22-3.
What is the molecular formula of (tert-Butylthio)acetic acid?
The molecular formula of (tert-Butylthio)acetic acid is C6H12O2S.
What is the molecular weight of (tert-Butylthio)acetic acid?
The molecular weight of (tert-Butylthio)acetic acid is 148.06 g/mol.
Where can I buy (tert-Butylthio)acetic acid?
You can request a quote for (tert-Butylthio)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (tert-Butylthio)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (tert-Butylthio)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.