N-tert-butyl-2,5-dichlorobenzamide
TL;DR: N-tert-butyl-2,5-dichlorobenzamide (CAS 212392-31-9) is a chemical compound with molecular formula C11H13Cl2NO and molecular weight 245.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-2,5-dichlorobenzamide
Also Known As: N-tert-butyl-2,5-dichlorobenzamide, 2,5-Dichloro-N-(1,1-dimethylethyl)benzamide, (2,5-dichlorophenyl)-N-(tert-butyl)carboxamide
| Molecular Formula | C11H13Cl2NO |
|---|---|
| Molecular Weight | 245.04 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.03741 |
| Heavy Atoms | 15 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 212392-31-9 |
|---|---|
| SMILES | CC(C)(C)NC(=O)C1=C(C=CC(=C1)Cl)Cl |
| InChIKey | LBFJDVWPXVVXFH-UHFFFAOYSA-N |
Product Overview
N-tert-butyl-2,5-dichlorobenzamide (CAS 212392-31-9), with molecular formula C11H13Cl2NO and molecular weight 245.04 g/mol. IUPAC: N-tert-butyl-2,5-dichlorobenzamide.
Chemical Property Profile of N-tert-butyl-2,5-dichlorobenzamide
Property Insights of N-tert-butyl-2,5-dichlorobenzamide
The XLogP value of 3.6 indicates that N-tert-butyl-2,5-dichlorobenzamide 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-tert-butyl-2,5-dichlorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-tert-butyl-2,5-dichlorobenzamide 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-tert-butyl-2,5-dichlorobenzamide?
The CAS number of N-tert-butyl-2,5-dichlorobenzamide is 212392-31-9.
What is the molecular formula of N-tert-butyl-2,5-dichlorobenzamide?
The molecular formula of N-tert-butyl-2,5-dichlorobenzamide is C11H13Cl2NO.
What is the molecular weight of N-tert-butyl-2,5-dichlorobenzamide?
The molecular weight of N-tert-butyl-2,5-dichlorobenzamide is 245.04 g/mol.
Where can I buy N-tert-butyl-2,5-dichlorobenzamide?
You can request a quote for N-tert-butyl-2,5-dichlorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-tert-butyl-2,5-dichlorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-tert-butyl-2,5-dichlorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.