2-chloro-N,N-diethyl-4-methylbenzamide
TL;DR: 2-chloro-N,N-diethyl-4-methylbenzamide (CAS 67272-91-7) is a chemical compound with molecular formula C12H16ClNO and molecular weight 225.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N,N-diethyl-4-methylbenzamide
Also Known As: 2-chloro-N,N-diethyl-4-methylbenzamide, 3-chloro-N,N-diethyl-p-toluamide, Benzamide, 2-chloro-N,N-diethyl-4-methyl-, AB00113261-01
| Molecular Formula | C12H16ClNO |
|---|---|
| Molecular Weight | 225.09 g/mol |
| LogP | 3.13042 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.09204 |
| Heavy Atoms | 15 |
| Complexity | 358.6398 |
Chemical Identifiers
| CAS Number | 67272-91-7 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=C(C=C(C=C1)C)Cl |
Product Overview
2-chloro-N,N-diethyl-4-methylbenzamide (CAS 67272-91-7), with molecular formula C12H16ClNO and molecular weight 225.09 g/mol. IUPAC: 2-chloro-N,N-diethyl-4-methylbenzamide.
Chemical Property Profile of 2-chloro-N,N-diethyl-4-methylbenzamide
Property Insights of 2-chloro-N,N-diethyl-4-methylbenzamide
The XLogP value of 3.13042 indicates that 2-chloro-N,N-diethyl-4-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, 2-chloro-N,N-diethyl-4-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N,N-diethyl-4-methylbenzamide has 0 hydrogen bond donor(s) and 1 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 2-chloro-N,N-diethyl-4-methylbenzamide?
The CAS number of 2-chloro-N,N-diethyl-4-methylbenzamide is 67272-91-7.
What is the molecular formula of 2-chloro-N,N-diethyl-4-methylbenzamide?
The molecular formula of 2-chloro-N,N-diethyl-4-methylbenzamide is C12H16ClNO.
What is the molecular weight of 2-chloro-N,N-diethyl-4-methylbenzamide?
The molecular weight of 2-chloro-N,N-diethyl-4-methylbenzamide is 225.09 g/mol.
Where can I buy 2-chloro-N,N-diethyl-4-methylbenzamide?
You can request a quote for 2-chloro-N,N-diethyl-4-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N,N-diethyl-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N,N-diethyl-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.