Isomerulidial
TL;DR: Isomerulidial (CAS 121843-89-8) is a chemical compound with molecular formula C15H20O3 and molecular weight 248.14125 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1aS,5aR,6S,6aS)-6-hydroxy-4,4,6a-trimethyl-3,5,5a,6-tetrahydro-1H-cyclopropa[f]indene-1a,2-dicarbaldehyde
Also Known As: Isomerulidial, Merulidial, (1aS,5aR,6S,6aS)-6-hydroxy-4,4,6a-trimethyl-3,5,5a,6-tetrahydro-1H-cyclopropa[f]indene-1a,2-dicarbaldehyde, Cycloprop(f)indene-1a,2(1H)-dicarboxaldehyde, 3,4,5,5a,6,6a-hexahydro-6-hydroxy-4,4,6a-trimethyl-, (1aS-(1aalpha,5aalpha,6alpha,6aalpha))-, (1aS,5aR,6S,6aS)-6-hydroxy-4,4,6a-trimethyl-3,5,5a,6-tetrahy
Technical Specifications
| Molecular Formula | C15H20O3 |
| Molecular Weight | 248.14125 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.14125 Da |
| Heavy Atoms | 18 |
| Complexity | 476.0 |
| SMILES | C[C@]12C[C@]1(C(=C3CC(C[C@H]3[C@@H]2O)(C)C)C=O)C=O |
| InChIKey | NFLNZGQBGCPDMT-DZGBDDFRSA-N |
Chemical Property Profile of Isomerulidial
Property Insights of Isomerulidial
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isomerulidial. With a topological polar surface area (TPSA) of 54.4 Ų, Isomerulidial exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isomerulidial has 1 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 Isomerulidial?
The CAS number of Isomerulidial is 121843-89-8.
What is the molecular formula of Isomerulidial?
The molecular formula of Isomerulidial is C15H20O3.
What is the molecular weight of Isomerulidial?
The molecular weight of Isomerulidial is 248.14125 g/mol.
Where can I buy Isomerulidial?
You can request a quote for Isomerulidial directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isomerulidial?
Yes, CoreyChem provides custom synthesis services for Isomerulidial and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.