5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid
TL;DR: 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid (CAS 134815-02-4) is a chemical compound with molecular formula C12H14ClNO3 and molecular weight 255.06622 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(4-chloroanilino)-3-methyl-5-oxopentanoic acid
Also Known As: 5-(4-chloroanilino)-3-methyl-5-oxopentanoic acid, 5-[(4-chlorophenyl)amino]-3-methyl-5-oxopentanoic acid, AS-662/43412910, 4-[(4-chlorophenyl)carbamoyl]-3-methyl-butanoic Acid
Technical Specifications
| Molecular Formula | C12H14ClNO3 |
| Molecular Weight | 255.06622 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 255.06622 Da |
| Heavy Atoms | 17 |
| Complexity | 275.0 |
| SMILES | CC(CC(=O)NC1=CC=C(C=C1)Cl)CC(=O)O |
| InChIKey | LDKIZWOJQDDRKE-UHFFFAOYSA-N |
Chemical Property Profile of 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid
Property Insights of 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid. Following Lipinski's Rule of Five, 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid has 2 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-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid?
The CAS number of 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid is 134815-02-4.
What is the molecular formula of 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid?
The molecular formula of 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid is C12H14ClNO3.
What is the molecular weight of 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid?
The molecular weight of 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid is 255.06622 g/mol.
Where can I buy 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid?
You can request a quote for 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid?
Yes, CoreyChem provides custom synthesis services for 5-(4-Chloroanilino)-3-methyl-5-oxopentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.