(3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3
TL;DR: (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3 (CAS 79307-07-6) is a chemical compound with molecular formula C20H22O7 and molecular weight 374.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,10-dimethyl-6-methylidene-5,13-dioxo-4,14-dioxatricyclo[9.2.1.03,7]tetradeca-9,11-dien-8-yl) 2,3-dimethyloxirane-2-carboxylate
Also Known As: (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3
| Molecular Formula | C20H22O7 |
|---|---|
| Molecular Weight | 374.14 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 91.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.13657 |
| Heavy Atoms | 27 |
| Complexity | 837.0 |
Chemical Identifiers
| CAS Number | 79307-07-6 |
|---|---|
| SMILES | CC1C(O1)(C)C(=O)OC2C=C(C3=CC(=O)C(O3)(CC4C2C(=C)C(=O)O4)C)C |
| InChIKey | IJGHTANSNPLNNN-UHFFFAOYSA-N |
Product Overview
(3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3 (CAS 79307-07-6), with molecular formula C20H22O7 and molecular weight 374.14 g/mol. IUPAC: (1,10-dimethyl-6-methylidene-5,13-dioxo-4,14-dioxatricyclo[9.2.1.03,7]tetradeca-9,11-dien-8-yl) 2,3-dimethyloxirane-2-carboxylate.
Chemical Property Profile of (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3
Property Insights of (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3. The TPSA of 91.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3. Following Lipinski's Rule of Five, (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3 has 0 hydrogen bond donor(s) and 7 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 (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3?
The CAS number of (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3 is 79307-07-6.
What is the molecular formula of (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3?
The molecular formula of (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3 is C20H22O7.
What is the molecular weight of (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3?
The molecular weight of (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3 is 374.14 g/mol.
Where can I buy (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3?
You can request a quote for (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3?
Yes, KEHONG BIO provides custom synthesis services for (3aR,4S,5Z,11aS)-6,10-dimethyl-3-methylidene-2,9-dioxo-2,3,3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.