beta-Agarofuran
TL;DR: beta-Agarofuran (CAS 6040-08-0) is a chemical compound with molecular formula C14H22O and molecular weight 206.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,9R)-6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodec-2-ene
Also Known As: .beta.-Agarofuran, beta-Agarofuran, (1S,6S,9R)-6,10,10-trimethyl-2-methylidene-11-oxatricyclo(7.2.1.01,6)dodecane, (1S,6S,9R)-6,10,10-trimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane, RefChem:119172
| Molecular Formula | C14H22O |
|---|---|
| Molecular Weight | 206.17 g/mol |
| LogP | 3.6904 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 206.16707 |
| Heavy Atoms | 15 |
| Complexity | 317.30038 |
Chemical Identifiers
| CAS Number | 6040-08-0 |
|---|---|
| SMILES | CC1([C@@H]2CCC3(CCC=C[C@]3(C2)O1)C)C |
Product Overview
beta-Agarofuran (CAS 6040-08-0), with molecular formula C14H22O and molecular weight 206.17 g/mol. IUPAC: (1S,9R)-6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodec-2-ene.
Chemical Property Profile of beta-Agarofuran
Property Insights of beta-Agarofuran
The XLogP value of 3.6904 indicates that beta-Agarofuran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, beta-Agarofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, beta-Agarofuran has 0 hydrogen bond donor(s) and 1 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 beta-Agarofuran?
The CAS number of beta-Agarofuran is 6040-08-0.
What is the molecular formula of beta-Agarofuran?
The molecular formula of beta-Agarofuran is C14H22O.
What is the molecular weight of beta-Agarofuran?
The molecular weight of beta-Agarofuran is 206.17 g/mol.
Where can I buy beta-Agarofuran?
You can request a quote for beta-Agarofuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Agarofuran?
Yes, KEHONG BIO provides custom synthesis services for beta-Agarofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.