2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)-
TL;DR: 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)- (CAS 101859-11-4) is a chemical compound with molecular formula C20H34O3 and molecular weight 322.2508 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2S,3R,4aS,8aR)-2-[(E)-non-2-enyl]-3,4,4a,5,6,7,8,8a-octahydro-2H-chromen-3-yl] acetate
Also Known As: 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)-, [(2S,3R,4aS,8aR)-2-[(E)-non-2-enyl]-3,4,4a,5,6,7,8,8a-octahydro-2H-chromen-3-yl] Acetate
Technical Specifications
| Molecular Formula | C20H34O3 |
| Molecular Weight | 322.2508 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 322.2508 Da |
| Heavy Atoms | 23 |
| Complexity | 377.0 |
| SMILES | CCCCCC/C=C/C[C@H]1[C@@H](C[C@@H]2CCCC[C@H]2O1)OC(=O)C |
| InChIKey | ZJMZUYPUJPUBRH-KDCGFWQMSA-N |
Chemical Property Profile of 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)-
Property Insights of 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)-
The XLogP value of 5.9 indicates that 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)-?
The CAS number of 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)- is 101859-11-4.
What is the molecular formula of 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)-?
The molecular formula of 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)- is C20H34O3.
What is the molecular weight of 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)-?
The molecular weight of 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)- is 322.2508 g/mol.
Where can I buy 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)-?
You can request a quote for 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)-?
Yes, CoreyChem provides custom synthesis services for 2H-1-Benzopyran-3-ol, octahydro-3-methyl-2-(2-nonenyl)-, formate, (2alpha(E),3beta,4aalpha,8abeta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.