1,3-Bis-t-butylperoxy-phthalan
TL;DR: 1,3-Bis-t-butylperoxy-phthalan (CAS 97526-35-7) is a chemical compound with molecular formula C16H24O5 and molecular weight 296.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(tert-butylperoxy)-1,3-dihydro-2-benzofuran
Also Known As: 1,3-Bis-t-butylperoxy-phthalan, 1,3-bis(tert-butylperoxy)-1,3-dihydroisobenzofuran, 1,3-Bis(tert-butylperoxy)-1,3-dihydro-2-benzofuran, 1,3-Bis(tert-butylperoxy)-1,3-dihydro-2-benzofuran #
| Molecular Formula | C16H24O5 |
|---|---|
| Molecular Weight | 296.16 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 296.16238 |
| Heavy Atoms | 21 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 97526-35-7 |
|---|---|
| SMILES | CC(C)(C)OOC1C2=CC=CC=C2C(O1)OOC(C)(C)C |
| InChIKey | RQMZGGUOZFASJD-UHFFFAOYSA-N |
Product Overview
1,3-Bis-t-butylperoxy-phthalan (CAS 97526-35-7), with molecular formula C16H24O5 and molecular weight 296.16 g/mol. IUPAC: 1,3-bis(tert-butylperoxy)-1,3-dihydro-2-benzofuran.
Chemical Property Profile of 1,3-Bis-t-butylperoxy-phthalan
Property Insights of 1,3-Bis-t-butylperoxy-phthalan
The XLogP value of 3.2 indicates that 1,3-Bis-t-butylperoxy-phthalan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.2 Ų, 1,3-Bis-t-butylperoxy-phthalan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Bis-t-butylperoxy-phthalan has 0 hydrogen bond donor(s) and 5 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 1,3-Bis-t-butylperoxy-phthalan?
The CAS number of 1,3-Bis-t-butylperoxy-phthalan is 97526-35-7.
What is the molecular formula of 1,3-Bis-t-butylperoxy-phthalan?
The molecular formula of 1,3-Bis-t-butylperoxy-phthalan is C16H24O5.
What is the molecular weight of 1,3-Bis-t-butylperoxy-phthalan?
The molecular weight of 1,3-Bis-t-butylperoxy-phthalan is 296.16 g/mol.
Where can I buy 1,3-Bis-t-butylperoxy-phthalan?
You can request a quote for 1,3-Bis-t-butylperoxy-phthalan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis-t-butylperoxy-phthalan?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis-t-butylperoxy-phthalan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.