1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde
TL;DR: 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde (CAS 119673-50-6) is a chemical compound with molecular formula C13H12FNO and molecular weight 217.09029 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-fluorophenyl)-2,5-dimethylpyrrole-3-carbaldehyde
Also Known As: carbaldehyde, 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde, OSM-S-2, OSM-S-02, 1-(4-Fluoro-phenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde
Technical Specifications
| Molecular Formula | C13H12FNO |
| Molecular Weight | 217.09029 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.09029 Da |
| Heavy Atoms | 16 |
| Complexity | 250.0 |
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C=O |
| InChIKey | COLPZCHNJIVKMV-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde
Property Insights of 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde. With a topological polar surface area (TPSA) of 22.0 Ų, 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde?
The CAS number of 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde is 119673-50-6.
What is the molecular formula of 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde?
The molecular formula of 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde is C13H12FNO.
What is the molecular weight of 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde?
The molecular weight of 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde is 217.09029 g/mol.
Where can I buy 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde?
You can request a quote for 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde?
Yes, CoreyChem provides custom synthesis services for 1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.