(S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid
TL;DR: (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid (CAS 4785-66-4) is a chemical compound with molecular formula C6H10O4S and molecular weight 178.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3S)-1,1-dioxothiolan-3-yl]acetic acid
Also Known As: (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid, 2-[(3S)-1,1-dioxothiolan-3-yl]acetic acid, [(3S)-1,1-dioxo-1??-thiolan-3-yl]acetic acid
| Molecular Formula | C6H10O4S |
|---|---|
| Molecular Weight | 178.03 g/mol |
| LogP | -0.1042 |
| Topological Polar Surface Area | 71.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.02998 |
| Heavy Atoms | 11 |
| Complexity | 253.75584 |
Chemical Identifiers
| CAS Number | 4785-66-4 |
|---|---|
| SMILES | C1CS(=O)(=O)C[C@H]1CC(=O)O |
Product Overview
(S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid (CAS 4785-66-4), with molecular formula C6H10O4S and molecular weight 178.03 g/mol. IUPAC: 2-[(3S)-1,1-dioxothiolan-3-yl]acetic acid.
Chemical Property Profile of (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid
Property Insights of (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid
The XLogP value of -0.1042 indicates that (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 71.44 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid. Following Lipinski's Rule of Five, (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)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 (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid?
The CAS number of (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid is 4785-66-4.
What is the molecular formula of (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid?
The molecular formula of (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid is C6H10O4S.
What is the molecular weight of (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid?
The molecular weight of (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid is 178.03 g/mol.
Where can I buy (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid?
You can request a quote for (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-(1,1-Dioxidotetrahydrothiophen-3-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.