2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct
TL;DR: 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct (CAS 14078-46-7) is a chemical compound with molecular formula C22H28O4 and molecular weight 356.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]octa-1(6),2,4-triene-8,6'-cyclohexa-2,4-diene]-1'-one
Also Known As: 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct, 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]octa-1(6),2,4-triene-8,6'-cyclohexa-2,4-diene]-1'-one, 2,3'-Di-tert-butyl-4,5'-dimethoxy-8-oxaspiro[bicyclo[4.2.0]octane-7,1'-cyclohexane]-1,3,3',5,5'-pentaen-2'-one
| Molecular Formula | C22H28O4 |
|---|---|
| Molecular Weight | 356.20 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.19876 |
| Heavy Atoms | 26 |
| Complexity | 646.0 |
Chemical Identifiers
| CAS Number | 14078-46-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC2=C1OC23C=C(C=C(C3=O)C(C)(C)C)OC)OC |
| InChIKey | QJKAJPSCURQEJT-UHFFFAOYSA-N |
Product Overview
2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct (CAS 14078-46-7), with molecular formula C22H28O4 and molecular weight 356.20 g/mol. IUPAC: 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]octa-1(6),2,4-triene-8,6'-cyclohexa-2,4-diene]-1'-one.
Chemical Property Profile of 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct
Property Insights of 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct
The XLogP value of 4.4 indicates that 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct has 0 hydrogen bond donor(s) and 4 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 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct?
The CAS number of 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct is 14078-46-7.
What is the molecular formula of 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct?
The molecular formula of 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct is C22H28O4.
What is the molecular weight of 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct?
The molecular weight of 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct is 356.20 g/mol.
Where can I buy 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct?
You can request a quote for 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct?
Yes, KEHONG BIO provides custom synthesis services for 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]oct and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.