4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid
TL;DR: 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid (CAS 956943-44-5) is a chemical compound with molecular formula C13H15N3O6 and molecular weight 309.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid
Also Known As: (2R)-4-methyl-1-(4-methyl-2,6-dinitrophenyl)tetrahydro-1H-pyrrole-2-carboxylic acid, 4-methyl-1-(4-methyl-2,6-dinitro-phenyl)pyrrolidine-2-carboxylic Acid, 4-methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid
| Molecular Formula | C13H15N3O6 |
|---|---|
| Molecular Weight | 309.10 g/mol |
| LogP | 2.11082 |
| Topological Polar Surface Area | 126.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.0961 |
| Heavy Atoms | 22 |
| Complexity | 624.17065 |
Chemical Identifiers
| CAS Number | 956943-44-5 |
|---|---|
| SMILES | CC1CC(N(C1)C2=C(C=C(C=C2[N+](=O)[O-])C)[N+](=O)[O-])C(=O)O |
Product Overview
4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid (CAS 956943-44-5), with molecular formula C13H15N3O6 and molecular weight 309.10 g/mol. IUPAC: 4-methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid.
Chemical Property Profile of 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid
Property Insights of 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid
The XLogP value of 2.11082 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid. The TPSA of 126.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid. Following Lipinski's Rule of Five, 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid?
The CAS number of 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid is 956943-44-5.
What is the molecular formula of 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid?
The molecular formula of 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid is C13H15N3O6.
What is the molecular weight of 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid?
The molecular weight of 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid is 309.10 g/mol.
Where can I buy 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid?
You can request a quote for 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-1-(4-methyl-2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.