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Acetic acid, [(1-methylpropyl)thio]-
TL;DR: Acetic acid, [(1-methylpropyl)thio]- (CAS 22683-43-8) 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-butan-2-ylsulfanylacetic acid
Also Known As: sec-butylsulfanyl-acetic acid, acetic acid, sec-butylthio-, (Sec-butylsulfanyl)acetic acid, Acetic acid, [(1-methylpropyl)thio]-, (butan-2-ylsulfanyl)acetic acid
| Molecular Formula | C6H12O2S |
|---|---|
| Molecular Weight | 148.06 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 148.0558 |
| Heavy Atoms | 9 |
| Complexity | 93.0 |
Chemical Identifiers
| CAS Number | 22683-43-8 |
|---|---|
| SMILES | CCC(C)SCC(=O)O |
| InChIKey | QHFJJZPTJJVNMG-UHFFFAOYSA-N |
Product Overview
Acetic acid, [(1-methylpropyl)thio]- (CAS 22683-43-8), with molecular formula C6H12O2S and molecular weight 148.06 g/mol. IUPAC: 2-butan-2-ylsulfanylacetic acid.
Chemical Property Profile of Acetic acid, [(1-methylpropyl)thio]-
Property Insights of Acetic acid, [(1-methylpropyl)thio]-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, [(1-methylpropyl)thio]-. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, [(1-methylpropyl)thio]-. Following Lipinski's Rule of Five, Acetic acid, [(1-methylpropyl)thio]- 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 Acetic acid, [(1-methylpropyl)thio]-?
The CAS number of Acetic acid, [(1-methylpropyl)thio]- is 22683-43-8.
What is the molecular formula of Acetic acid, [(1-methylpropyl)thio]-?
The molecular formula of Acetic acid, [(1-methylpropyl)thio]- is C6H12O2S.
What is the molecular weight of Acetic acid, [(1-methylpropyl)thio]-?
The molecular weight of Acetic acid, [(1-methylpropyl)thio]- is 148.06 g/mol.
Where can I buy Acetic acid, [(1-methylpropyl)thio]-?
You can request a quote for Acetic acid, [(1-methylpropyl)thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, [(1-methylpropyl)thio]-?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, [(1-methylpropyl)thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.