2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid
TL;DR: 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid (CAS 111831-93-7) is a chemical compound with molecular formula C10H12ClNO2 and molecular weight 213.05565 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-chlorophenyl)-2-(dimethylamino)acetic acid
Also Known As: (4-Chloro-phenyl)-dimethylamino-acetic acid, 2-(4-chlorophenyl)-2-(dimethylamino)acetic acid, But-2-ynyl-cyclohexyl-amine, (4-chlorophenyl)(dimethylamino)acetic acid, 5-nitropyrrole-2-carboxyaldehyde
Technical Specifications
| Molecular Formula | C10H12ClNO2 |
| Molecular Weight | 213.05565 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.05565 Da |
| Heavy Atoms | 14 |
| Complexity | 200.0 |
| SMILES | CN(C)C(C1=CC=C(C=C1)Cl)C(=O)O |
| InChIKey | MNNZTQAXBCVWKK-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid
Property Insights of 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid
The XLogP value of -0.1 indicates that 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.5 Ų, 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chlorophenyl)-2-(dimethylamino)acetic 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 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid?
The CAS number of 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid is 111831-93-7.
What is the molecular formula of 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid?
The molecular formula of 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid is C10H12ClNO2.
What is the molecular weight of 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid?
The molecular weight of 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid is 213.05565 g/mol.
Where can I buy 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid?
You can request a quote for 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid?
Yes, CoreyChem provides custom synthesis services for 2-(4-Chlorophenyl)-2-(dimethylamino)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.