N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide
TL;DR: N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide (CAS 335204-02-9) is a chemical compound with molecular formula C12H15ClN2O3 and molecular weight 270.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide
Also Known As: N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide, BAS 02256143, N-{4-chloro-3-nitrophenyl}-3,3-dimethylbutanamide, N-(4-Chloro-3-nitro-phenyl)-3,3-dimethyl-butyramide
| Molecular Formula | C12H15ClN2O3 |
|---|---|
| Molecular Weight | 270.08 g/mol |
| LogP | 3.6229 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 270.07712 |
| Heavy Atoms | 18 |
| Complexity | 480.70114 |
Chemical Identifiers
| CAS Number | 335204-02-9 |
|---|---|
| SMILES | CC(C)(C)CC(=O)NC1=CC(=C(C=C1)Cl)[N+](=O)[O-] |
Product Overview
N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide (CAS 335204-02-9), with molecular formula C12H15ClN2O3 and molecular weight 270.08 g/mol. IUPAC: N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide.
Chemical Property Profile of N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide
Property Insights of N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide
The XLogP value of 3.6229 indicates that N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide. Following Lipinski's Rule of Five, N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide has 1 hydrogen bond donor(s) and 3 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-chloro-3-nitrophenyl)-3,3-dimethylbutanamide?
The CAS number of N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide is 335204-02-9.
What is the molecular formula of N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide?
The molecular formula of N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide is C12H15ClN2O3.
What is the molecular weight of N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide?
The molecular weight of N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide is 270.08 g/mol.
Where can I buy N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide?
You can request a quote for N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-chloro-3-nitrophenyl)-3,3-dimethylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.