7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate
TL;DR: 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate (CAS 39083-44-8) is a chemical compound with molecular formula C34H50O6 and molecular weight 554.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-acetyloxy-4,4,10,13,14-pentamethyl-17-(6-methylheptan-2-yl)-7,11-dioxo-2,3,12,15,16,17-hexahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
Also Known As: 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate, [6-acetyloxy-4,4,10,13,14-pentamethyl-17-(6-methylheptan-2-yl)-7,11-dioxo-2,3,12,15,16,17-hexahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
| Molecular Formula | C34H50O6 |
|---|---|
| Molecular Weight | 554.36 g/mol |
| LogP | 7.9 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 554.3607 |
| Heavy Atoms | 40 |
| Complexity | 1190.0 |
Chemical Identifiers
| CAS Number | 39083-44-8 |
|---|---|
| SMILES | CC(C)CCCC(C)C1CCC2(C1(CC(=O)C3=C2C(=O)C(=C4C3(CCC(C4(C)C)OC(=O)C)C)OC(=O)C)C)C |
| InChIKey | XECKPKBVPIZNRF-UHFFFAOYSA-N |
Product Overview
7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate (CAS 39083-44-8), with molecular formula C34H50O6 and molecular weight 554.36 g/mol. IUPAC: [6-acetyloxy-4,4,10,13,14-pentamethyl-17-(6-methylheptan-2-yl)-7,11-dioxo-2,3,12,15,16,17-hexahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate.
Chemical Property Profile of 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate
Property Insights of 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate
The XLogP value of 7.9 indicates that 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate. Following Lipinski's Rule of Five, 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate?
The CAS number of 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate is 39083-44-8.
What is the molecular formula of 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate?
The molecular formula of 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate is C34H50O6.
What is the molecular weight of 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate?
The molecular weight of 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate is 554.36 g/mol.
Where can I buy 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate?
You can request a quote for 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate?
Yes, KEHONG BIO provides custom synthesis services for 7,11-Dioxolanosta-5,8-diene-3,6-diyl diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.