Dehydrobaimuxinol
TL;DR: Dehydrobaimuxinol (CAS 105013-74-9) is a chemical compound with molecular formula C15H24O2 and molecular weight 236.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,6S,9R)-6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodec-2-en-2-yl]methanol
Also Known As: Dehydrobaimuxinol, (+)-Dehydrobaimuxinol, [(1R,6S,9R)-6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodec-2-en-2-yl]methanol, (2,2,5a-Trimethyl-3,4,5,5a,6,7-hexahydro-2H-3,9a-methano-1-benzoxepin-9-yl)methanol, ((3R,5aS,9aR)-2,2,5a-Trimethyl-3,4,5,5a,6,7-hexahydro-2H-3,9a-methanobenzo[b]oxepin-9-yl)methanol
| Molecular Formula | C15H24O2 |
|---|---|
| Molecular Weight | 236.18 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.17763 |
| Heavy Atoms | 17 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 105013-74-9 |
|---|---|
| SMILES | C[C@@]12CCC=C([C@@]13C[C@@H](CC2)C(O3)(C)C)CO |
| InChIKey | JDBYBUVTDVWOAW-UGFHNGPFSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dehydrobaimuxinol (CAS 105013-74-9), with molecular formula C15H24O2 and molecular weight 236.18 g/mol. IUPAC: [(1R,6S,9R)-6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodec-2-en-2-yl]methanol.
Chemical Property Profile of Dehydrobaimuxinol
Property Insights of Dehydrobaimuxinol
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dehydrobaimuxinol. With a topological polar surface area (TPSA) of 29.5 Ų, Dehydrobaimuxinol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dehydrobaimuxinol has 1 hydrogen bond donor(s) and 2 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 Dehydrobaimuxinol?
The CAS number of Dehydrobaimuxinol is 105013-74-9.
What is the molecular formula of Dehydrobaimuxinol?
The molecular formula of Dehydrobaimuxinol is C15H24O2.
What is the molecular weight of Dehydrobaimuxinol?
The molecular weight of Dehydrobaimuxinol is 236.18 g/mol.
Where can I buy Dehydrobaimuxinol?
You can request a quote for Dehydrobaimuxinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dehydrobaimuxinol?
Yes, KEHONG BIO provides custom synthesis services for Dehydrobaimuxinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.