S-N-BUTYLTHIOACETATE
TL;DR: S-N-BUTYLTHIOACETATE (CAS 18422-54-3) is a chemical compound with molecular formula C12H20O6 and molecular weight 260.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2',2'-tetramethylspiro[1,3-dioxolane-4,6'-3a,4,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran]-7'-ol
Also Known As: S-N-BUTYLTHIOACETATE, 1,2:4,5-Di-O-isopropylidene-beta-D-fructopyranose, 1,2,4,5-DIISOPROPYLIDENE-D-FRUCTOSE, J3.275.000A, 1,2:4,5-Di-O-isopropylidene-
| Molecular Formula | C12H20O6 |
|---|---|
| Molecular Weight | 260.13 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 260.12598 |
| Heavy Atoms | 18 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 18422-54-3 |
|---|---|
| SMILES | CC1(OCC2(O1)C(C3C(CO2)OC(O3)(C)C)O)C |
| InChIKey | NFHXOQDPQIQPKT-UHFFFAOYSA-N |
Product Overview
S-N-BUTYLTHIOACETATE (CAS 18422-54-3), with molecular formula C12H20O6 and molecular weight 260.13 g/mol. IUPAC: 2,2,2',2'-tetramethylspiro[1,3-dioxolane-4,6'-3a,4,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran]-7'-ol.
Chemical Property Profile of S-N-BUTYLTHIOACETATE
Property Insights of S-N-BUTYLTHIOACETATE
The XLogP value of -0.3 indicates that S-N-BUTYLTHIOACETATE is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for S-N-BUTYLTHIOACETATE. Following Lipinski's Rule of Five, S-N-BUTYLTHIOACETATE has 1 hydrogen bond donor(s) and 6 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-N-BUTYLTHIOACETATE?
The CAS number of S-N-BUTYLTHIOACETATE is 18422-54-3.
What is the molecular formula of S-N-BUTYLTHIOACETATE?
The molecular formula of S-N-BUTYLTHIOACETATE is C12H20O6.
What is the molecular weight of S-N-BUTYLTHIOACETATE?
The molecular weight of S-N-BUTYLTHIOACETATE is 260.13 g/mol.
Where can I buy S-N-BUTYLTHIOACETATE?
You can request a quote for S-N-BUTYLTHIOACETATE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-N-BUTYLTHIOACETATE?
Yes, KEHONG BIO provides custom synthesis services for S-N-BUTYLTHIOACETATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.