Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)-
TL;DR: Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)- (CAS 70981-24-7) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6Z,8aR,11aR)-1,4,5,8,8a,10,11,11a-octahydrocyclopenta[d]oxecine-2,9-dione
Also Known As: Jasmine ketolactone, Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)-, (1R,3Z,10R)-7-Oxabicyclo[8.3.0]trideca-3-ene-8,13-dione, (1R,7Z,10S)-4-oxabicyclo[8.3.0]tridec-7-ene-3,11-dione, (6Z,8aR,11aR)-1,4,5,8,8a,10,11,11a-octahydrocyclopenta[d]oxecine-2,9-dione
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 1.865 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 293.24237 |
Chemical Identifiers
| CAS Number | 70981-24-7 |
|---|---|
| SMILES | C/1COC(=O)C[C@H]2CCC(=O)[C@@H]2C/C=C1 |
Product Overview
Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)- (CAS 70981-24-7), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: (6Z,8aR,11aR)-1,4,5,8,8a,10,11,11a-octahydrocyclopenta[d]oxecine-2,9-dione.
Chemical Property Profile of Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)-
Property Insights of Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)-
The XLogP value of 1.865 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)-. With a topological polar surface area (TPSA) of 43.37 Ų, Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)- has 0 hydrogen bond donor(s) and 3 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 Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)-?
The CAS number of Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)- is 70981-24-7.
What is the molecular formula of Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)-?
The molecular formula of Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)- is C12H16O3.
What is the molecular weight of Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)-?
The molecular weight of Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)- is 208.11 g/mol.
Where can I buy Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)-?
You can request a quote for Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)-?
Yes, KEHONG BIO provides custom synthesis services for Cyclopent(d)oxecin-2,9-dione, 1,4,5,8,8a,10,11,11a-octahydro-, (6Z,8aR,11aR)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.