N-(4-(tert-Butyl)-2-chlorophenyl)acetamide
TL;DR: N-(4-(tert-Butyl)-2-chlorophenyl)acetamide (CAS 100141-30-8) 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.
N-(4-tert-butyl-2-chlorophenyl)acetamide
Also Known As: N-(4-(tert-Butyl)-2-chlorophenyl)acetamide, N-(4-tert-butyl-2-chlorophenyl)acetamide, 0107AA, Acetanilide, 2-chloro-4-tert-butyl-, Acetamide, N-[2-chloro-4-(1,1-dimethylethyl)phenyl]-
| Molecular Formula | C12H16ClNO |
|---|---|
| Molecular Weight | 225.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.09204 |
| Heavy Atoms | 15 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 100141-30-8 |
|---|---|
| SMILES | CC(=O)NC1=C(C=C(C=C1)C(C)(C)C)Cl |
| InChIKey | NQEYFCHLAJWJIX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(4-(tert-Butyl)-2-chlorophenyl)acetamide (CAS 100141-30-8), with molecular formula C12H16ClNO and molecular weight 225.09 g/mol. IUPAC: N-(4-tert-butyl-2-chlorophenyl)acetamide.
Chemical Property Profile of N-(4-(tert-Butyl)-2-chlorophenyl)acetamide
Property Insights of N-(4-(tert-Butyl)-2-chlorophenyl)acetamide
The XLogP value of 3.0 indicates that N-(4-(tert-Butyl)-2-chlorophenyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-(4-(tert-Butyl)-2-chlorophenyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-(tert-Butyl)-2-chlorophenyl)acetamide 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
Frequently Asked Questions
What is the CAS number of N-(4-(tert-Butyl)-2-chlorophenyl)acetamide?
The CAS number of N-(4-(tert-Butyl)-2-chlorophenyl)acetamide is 100141-30-8.
What is the molecular formula of N-(4-(tert-Butyl)-2-chlorophenyl)acetamide?
The molecular formula of N-(4-(tert-Butyl)-2-chlorophenyl)acetamide is C12H16ClNO.
What is the molecular weight of N-(4-(tert-Butyl)-2-chlorophenyl)acetamide?
The molecular weight of N-(4-(tert-Butyl)-2-chlorophenyl)acetamide is 225.09 g/mol.
Where can I buy N-(4-(tert-Butyl)-2-chlorophenyl)acetamide?
You can request a quote for N-(4-(tert-Butyl)-2-chlorophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-(tert-Butyl)-2-chlorophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-(tert-Butyl)-2-chlorophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.