5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid
TL;DR: 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid (CAS 136088-16-9) is a chemical compound with molecular formula C6H9NO2 and molecular weight 127.06333 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid
Also Known As: 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid, 5-Methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid hydrochloride, 2H-pyrrole-2-carboxylic acid, 3,4-dihydro-5-methyl-, hydrochloride
Technical Specifications
| Molecular Formula | C6H9NO2 |
| Molecular Weight | 127.06333 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 49.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 127.06333 Da |
| Heavy Atoms | 9 |
| Complexity | 162.0 |
| SMILES | CC1=NC(CC1)C(=O)O |
| InChIKey | KPVXTRPRSOUYMZ-UHFFFAOYSA-N |
Chemical Property Profile of 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid
Property Insights of 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid
The XLogP value of -0.2 indicates that 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.7 Ų, 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid 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 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid?
The CAS number of 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid is 136088-16-9.
What is the molecular formula of 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid?
The molecular formula of 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid is C6H9NO2.
What is the molecular weight of 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid?
The molecular weight of 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid is 127.06333 g/mol.
Where can I buy 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid?
You can request a quote for 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 5-methyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.