![(3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol structure](/static/products/877/87745-20-8.png)
(3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol
TL;DR: (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol (CAS 87745-20-8) is a chemical compound with molecular formula C20H30O and molecular weight 286.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5aS,6R,10aR)-5a,10a-dimethyl-9-methylidene-3-propan-2-yl-2,4,5,6,7,8-hexahydro-1H-benzo[f]azulen-6-ol
Also Known As: (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol
| Molecular Formula | C20H30O |
|---|---|
| Molecular Weight | 286.23 g/mol |
| LogP | 5.1765 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 286.22968 |
| Heavy Atoms | 21 |
| Complexity | 536.0417 |
Chemical Identifiers
| CAS Number | 87745-20-8 |
|---|---|
| SMILES | CC(C)C1=C2CC[C@@]3([C@@H](CCC(=C)C3=C[C@]2(CC1)C)O)C |
Product Overview
(3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol (CAS 87745-20-8), with molecular formula C20H30O and molecular weight 286.23 g/mol. IUPAC: (5aS,6R,10aR)-5a,10a-dimethyl-9-methylidene-3-propan-2-yl-2,4,5,6,7,8-hexahydro-1H-benzo[f]azulen-6-ol.
Chemical Property Profile of (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol
Property Insights of (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol
The XLogP value of 5.1765 indicates that (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol?
The CAS number of (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol is 87745-20-8.
What is the molecular formula of (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol?
The molecular formula of (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol is C20H30O.
What is the molecular weight of (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol?
The molecular weight of (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol is 286.23 g/mol.
Where can I buy (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol?
You can request a quote for (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol?
Yes, KEHONG BIO provides custom synthesis services for (3aR,8R,8aS)-2,3,3a,5,6,7,8,8a,9,10-Decahydro-3a,8a-dimethyl-5-methylene-1-(1-methylethyl)benz[f]azulen-8-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.