Aromaticin
TL;DR: Aromaticin (CAS 5945-42-6) is a chemical compound with molecular formula C15H18O3 and molecular weight 246.1256 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,8a-dimethyl-1-methylidene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
Also Known As: Aromaticin, 4a,8-dimethyl-3-methylidene-3,3a,4,4a,7a,8,9,9a-octahydroazuleno[6,5-b]furan-2,5-dione, 5,8a-dimethyl-1-methylidene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
Technical Specifications
| Molecular Formula | C15H18O3 |
| Molecular Weight | 246.1256 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 246.1256 Da |
| Heavy Atoms | 18 |
| Complexity | 476.0 |
| SMILES | CC1CC2C(CC3(C1C=CC3=O)C)C(=C)C(=O)O2 |
| InChIKey | OSSDUQKWVVZIGP-UHFFFAOYSA-N |
Chemical Property Profile of Aromaticin
Property Insights of Aromaticin
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aromaticin. With a topological polar surface area (TPSA) of 43.4 Ų, Aromaticin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aromaticin has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Aromaticin?
The CAS number of Aromaticin is 5945-42-6.
What is the molecular formula of Aromaticin?
The molecular formula of Aromaticin is C15H18O3.
What is the molecular weight of Aromaticin?
The molecular weight of Aromaticin is 246.1256 g/mol.
Where can I buy Aromaticin?
You can request a quote for Aromaticin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Aromaticin?
Yes, CoreyChem provides custom synthesis services for Aromaticin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.