Epoxyguaiene
TL;DR: Epoxyguaiene (CAS 79030-44-7) is a chemical compound with molecular formula C15H24O and molecular weight 220.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3',3',4-tetramethylspiro[2,3,4,5,6,8-hexahydro-1H-azulene-7,2'-oxirane]
Also Known As: Epoxyguaiene, Epoxy guaiene, 3,3',3',8-tetramethyl-2,3,4,6,7,8-hexahydro-1h-spiro[azulene-5,2'-oxirane], 1,2,3,4,5,6,7,8-Octahydro-7-isopropylidene-1,4-dimethyl-,-epoxyazulene, 1,2,3,4,5,6,7,8-Octahydro-1,4-dimethyl-7-(1-methylethylidene)azulene monoepoxide
| Molecular Formula | C15H24O |
|---|---|
| Molecular Weight | 220.18 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 220.18271 |
| Heavy Atoms | 16 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 79030-44-7 |
|---|---|
| SMILES | CC1CCC2=C1CC3(CCC2C)C(O3)(C)C |
| InChIKey | UNUMEFUKAQEVMS-UHFFFAOYSA-N |
Product Overview
Epoxyguaiene (CAS 79030-44-7), with molecular formula C15H24O and molecular weight 220.18 g/mol. IUPAC: 1,3',3',4-tetramethylspiro[2,3,4,5,6,8-hexahydro-1H-azulene-7,2'-oxirane].
Chemical Property Profile of Epoxyguaiene
Property Insights of Epoxyguaiene
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Epoxyguaiene. With a topological polar surface area (TPSA) of 12.5 Ų, Epoxyguaiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Epoxyguaiene 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 Epoxyguaiene?
The CAS number of Epoxyguaiene is 79030-44-7.
What is the molecular formula of Epoxyguaiene?
The molecular formula of Epoxyguaiene is C15H24O.
What is the molecular weight of Epoxyguaiene?
The molecular weight of Epoxyguaiene is 220.18 g/mol.
Where can I buy Epoxyguaiene?
You can request a quote for Epoxyguaiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epoxyguaiene?
Yes, KEHONG BIO provides custom synthesis services for Epoxyguaiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.