1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde
TL;DR: 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde (CAS 132688-31-4) is a chemical compound with molecular formula C13H13NO and molecular weight 199.09972 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,6-dimethylphenyl)pyrrole-3-carbaldehyde
Also Known As: 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde, 1-(2,6-dimethylphenyl)pyrrole-3-carbaldehyde, BB 0249281, J3.078.096E, 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carboxaldehyde
Technical Specifications
| Molecular Formula | C13H13NO |
| Molecular Weight | 199.09972 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.09972 Da |
| Heavy Atoms | 15 |
| Complexity | 219.0 |
| SMILES | CC1=C(C(=CC=C1)C)N2C=CC(=C2)C=O |
| InChIKey | XGYWMIOYSRBPAT-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde
Property Insights of 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde. With a topological polar surface area (TPSA) of 22.0 Ų, 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde has 0 hydrogen bond donor(s) and 1 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-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde?
The CAS number of 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde is 132688-31-4.
What is the molecular formula of 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde?
The molecular formula of 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde is C13H13NO.
What is the molecular weight of 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde?
The molecular weight of 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde is 199.09972 g/mol.
Where can I buy 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde?
You can request a quote for 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde?
Yes, CoreyChem provides custom synthesis services for 1-(2,6-dimethylphenyl)-1H-pyrrole-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.