4-chloro-N-(2,4,6-trimethylphenyl)butanamide
TL;DR: 4-chloro-N-(2,4,6-trimethylphenyl)butanamide (CAS 121513-35-7) is a chemical compound with molecular formula C13H18ClNO and molecular weight 239.1077 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-N-(2,4,6-trimethylphenyl)butanamide
Also Known As: 4-Chloro-N-mesitylbutanamide, Carnosicacid, 4-chloro-N-(2,4,6-trimethylphenyl)butanamide, 4-Chloro-N-(2,4,6-trimethyl-phenyl)-butyramide, Butanamide, 4-chloro-N-(2,4,6-trimethylphenyl)-
Technical Specifications
| Molecular Formula | C13H18ClNO |
| Molecular Weight | 239.1077 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 239.1077 Da |
| Heavy Atoms | 16 |
| Complexity | 220.0 |
| SMILES | CC1=CC(=C(C(=C1)C)NC(=O)CCCCl)C |
| InChIKey | JLSHBNHLTMDYRK-UHFFFAOYSA-N |
Chemical Property Profile of 4-chloro-N-(2,4,6-trimethylphenyl)butanamide
Property Insights of 4-chloro-N-(2,4,6-trimethylphenyl)butanamide
The XLogP value of 3.1 indicates that 4-chloro-N-(2,4,6-trimethylphenyl)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 4-chloro-N-(2,4,6-trimethylphenyl)butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-N-(2,4,6-trimethylphenyl)butanamide has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-chloro-N-(2,4,6-trimethylphenyl)butanamide?
The CAS number of 4-chloro-N-(2,4,6-trimethylphenyl)butanamide is 121513-35-7.
What is the molecular formula of 4-chloro-N-(2,4,6-trimethylphenyl)butanamide?
The molecular formula of 4-chloro-N-(2,4,6-trimethylphenyl)butanamide is C13H18ClNO.
What is the molecular weight of 4-chloro-N-(2,4,6-trimethylphenyl)butanamide?
The molecular weight of 4-chloro-N-(2,4,6-trimethylphenyl)butanamide is 239.1077 g/mol.
Where can I buy 4-chloro-N-(2,4,6-trimethylphenyl)butanamide?
You can request a quote for 4-chloro-N-(2,4,6-trimethylphenyl)butanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-chloro-N-(2,4,6-trimethylphenyl)butanamide?
Yes, CoreyChem provides custom synthesis services for 4-chloro-N-(2,4,6-trimethylphenyl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.