(3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole]
TL;DR: (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole] (CAS 294183-73-6) is a chemical compound with molecular formula C22H36O6 and molecular weight 396.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aR,5R,6S,6aR)-5-(1,4-dioxaspiro[4.5]decan-3-yl)-6-(2-methylpropoxy)spiro[3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole-2,1'-cyclohexane]
Also Known As: (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole], (3aR,5R,6S,6aR)-5-(1,4-dioxaspiro[4.5]decan-3-yl)-6-(2-methylpropoxy)spiro[3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole-2,1'-cyclohexane]
| Molecular Formula | C22H36O6 |
|---|---|
| Molecular Weight | 396.25 g/mol |
| LogP | 3.9041 |
| Topological Polar Surface Area | 55.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.2512 |
| Heavy Atoms | 28 |
| Complexity | 539.1451 |
Chemical Identifiers
| CAS Number | 294183-73-6 |
|---|---|
| SMILES | CC(C)CO[C@@H]1[C@@H]2[C@H](O[C@@H]1C3COC4(O3)CCCCC4)OC5(O2)CCCCC5 |
Product Overview
(3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole] (CAS 294183-73-6), with molecular formula C22H36O6 and molecular weight 396.25 g/mol. IUPAC: (3aR,5R,6S,6aR)-5-(1,4-dioxaspiro[4.5]decan-3-yl)-6-(2-methylpropoxy)spiro[3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole-2,1'-cyclohexane].
Chemical Property Profile of (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole]
Property Insights of (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole]
The XLogP value of 3.9041 indicates that (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.38 Ų, (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole] has 0 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 (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole]?
The CAS number of (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole] is 294183-73-6.
What is the molecular formula of (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole]?
The molecular formula of (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole] is C22H36O6.
What is the molecular weight of (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole]?
The molecular weight of (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole] is 396.25 g/mol.
Where can I buy (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole]?
You can request a quote for (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole]?
Yes, KEHONG BIO provides custom synthesis services for (3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.