3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE
TL;DR: 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE (CAS 53821-66-2) is a chemical compound with molecular formula C20H26O10S and molecular weight 458.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-acetyloxy-2,2-dimethyl-8-(4-methylphenyl)sulfonyloxy-1,3,10-trioxaspiro[4.5]decan-7-yl] acetate
Also Known As: 4-Ethoxy-3-Methoxyphenylacetonitrile, 3,4-Di-O-acetyl-1,2-O-isopropylidene-5-O-tosyl-a-L-sorbose, 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE, 3,4-Di-O-acetyl-1,2-O-isopropylidene-5-O-tosyl-I+/--L-sorbose, [(5S,6S,7S,8S)-6-acetyloxy-2,2-dimethyl-8-(4-methylphenyl)sulfonyloxy-1,3,10-trioxaspiro[4.5]decan-7-yl] acetate
| Molecular Formula | C20H26O10S |
|---|---|
| Molecular Weight | 458.12 g/mol |
| LogP | 1.44172 |
| Topological Polar Surface Area | 123.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 458.12466 |
| Heavy Atoms | 31 |
| Complexity | 939.21216 |
Chemical Identifiers
| CAS Number | 53821-66-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2COC3(COC(O3)(C)C)C(C2OC(=O)C)OC(=O)C |
Product Overview
3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE (CAS 53821-66-2), with molecular formula C20H26O10S and molecular weight 458.12 g/mol. IUPAC: [6-acetyloxy-2,2-dimethyl-8-(4-methylphenyl)sulfonyloxy-1,3,10-trioxaspiro[4.5]decan-7-yl] acetate.
Chemical Property Profile of 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE
Property Insights of 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE
The XLogP value of 1.44172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE. The TPSA of 123.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE. Following Lipinski's Rule of Five, 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE has 0 hydrogen bond donor(s) and 10 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 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE?
The CAS number of 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE is 53821-66-2.
What is the molecular formula of 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE?
The molecular formula of 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE is C20H26O10S.
What is the molecular weight of 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE?
The molecular weight of 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE is 458.12 g/mol.
Where can I buy 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE?
You can request a quote for 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE?
Yes, KEHONG BIO provides custom synthesis services for 3,4-DI-O-ACETYL-1,2-O-ISOPROPYLIDENE-5-O-TOSYL-alpha-L-SORBOPYRANSE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.