4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide
TL;DR: 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide (CAS 27333-05-7) is a chemical compound with molecular formula C26H35ClN2O4 and molecular weight 474.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4-chloro-3-nitrophenyl)butanamide
Also Known As: EINECS 248-413-7, 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide, 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4-chloro-3-nitrophenyl)butanamide, Butanamide,2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-N-(4-chloro-3-nitrophenyl)-, N-(4-Chloro-3-nitrophenyl)-2-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyramide
| Molecular Formula | C26H35ClN2O4 |
|---|---|
| Molecular Weight | 474.23 g/mol |
| LogP | 7.4195 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 474.22855 |
| Heavy Atoms | 33 |
| Complexity | 1017.3466 |
Chemical Identifiers
| CAS Number | 27333-05-7 |
|---|---|
| SMILES | CCC(C(=O)NC1=CC(=C(C=C1)Cl)[N+](=O)[O-])OC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC |
Product Overview
4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide (CAS 27333-05-7), with molecular formula C26H35ClN2O4 and molecular weight 474.23 g/mol. IUPAC: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4-chloro-3-nitrophenyl)butanamide.
Chemical Property Profile of 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide
Property Insights of 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide
The XLogP value of 7.4195 indicates that 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide. Following Lipinski's Rule of Five, 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide?
The CAS number of 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide is 27333-05-7.
What is the molecular formula of 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide?
The molecular formula of 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide is C26H35ClN2O4.
What is the molecular weight of 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide?
The molecular weight of 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide is 474.23 g/mol.
Where can I buy 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide?
You can request a quote for 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide?
Yes, KEHONG BIO provides custom synthesis services for 4'-Chloro-2-(2,4-di-tert-pentylphenoxy)-3'-nitrobutyranilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.