1-methanesulfonyl-1H-pyrrole-2-carbaldehyde
TL;DR: 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde (CAS 123892-38-6) is a chemical compound with molecular formula C6H7NO3S and molecular weight 173.01466 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methylsulfonylpyrrole-2-carbaldehyde
Also Known As: 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde, 1-methylsulfonylpyrrole-2-carbaldehyde, 1-(methylsulfonyl)-1H-pyrrole-2-carbaldehyde, 1H-Pyrrole-2-carboxaldehyde, 1-(methylsulfonyl)-, 1-Methylsulfonylpyrrole-2-carboxaldehyde
Technical Specifications
| Molecular Formula | C6H7NO3S |
| Molecular Weight | 173.01466 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 64.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 173.01466 Da |
| Heavy Atoms | 11 |
| Complexity | 241.0 |
| SMILES | CS(=O)(=O)N1C=CC=C1C=O |
| InChIKey | NHOBBIVFUQBEMI-UHFFFAOYSA-N |
Chemical Property Profile of 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde
Property Insights of 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde. The TPSA of 64.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde. Following Lipinski's Rule of Five, 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde 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 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde?
The CAS number of 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde is 123892-38-6.
What is the molecular formula of 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde?
The molecular formula of 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde is C6H7NO3S.
What is the molecular weight of 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde?
The molecular weight of 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde is 173.01466 g/mol.
Where can I buy 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde?
You can request a quote for 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde?
Yes, CoreyChem provides custom synthesis services for 1-methanesulfonyl-1H-pyrrole-2-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.