dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate
TL;DR: dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate (CAS 66423-09-4) is a chemical compound with molecular formula C12H16ClNO3 and molecular weight 257.08188 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate
Also Known As: Mixture Name, Mecoprop-P-dimethylammonium, dimethylamino -2- propanoate, Mecoprop-P-dimethylammonium [ISO], (R)-Mecoprop dimethylamine salt
Technical Specifications
| Molecular Formula | C12H16ClNO3 |
| Molecular Weight | 257.08188 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 257.08188 Da |
| Heavy Atoms | 17 |
| Complexity | 260.0 |
| SMILES | CC1=C(C=CC(=C1)Cl)O[C@@H](C)C(=O)ON(C)C |
| InChIKey | LXJHMZRHVGVBIX-VIFPVBQESA-N |
Chemical Property Profile of dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate
Property Insights of dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate
The XLogP value of 3.7 indicates that dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate?
The CAS number of dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate is 66423-09-4.
What is the molecular formula of dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate?
The molecular formula of dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate is C12H16ClNO3.
What is the molecular weight of dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate?
The molecular weight of dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate is 257.08188 g/mol.
Where can I buy dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate?
You can request a quote for dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate?
Yes, CoreyChem provides custom synthesis services for dimethylamino (2S)-2-(4-chloro-2-methylphenoxy)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.