Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)-
TL;DR: Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)- (CAS 87315-20-6) is a chemical compound with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-N-(4-nitrophenyl)butanamide
Also Known As: 3,3-dimethyl-N-(4-nitrophenyl)butanamide, Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)-, 4-nitro-3,3-dimethylbutyrylaminobenzene, Cambridge id 7017669
| Molecular Formula | C12H16N2O3 |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | 2.9695 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.11609 |
| Heavy Atoms | 17 |
| Complexity | 418.37204 |
Chemical Identifiers
| CAS Number | 87315-20-6 |
|---|---|
| SMILES | CC(C)(C)CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)- (CAS 87315-20-6), with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol. IUPAC: 3,3-dimethyl-N-(4-nitrophenyl)butanamide.
Chemical Property Profile of Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)-
Property Insights of Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)-
The XLogP value of 2.9695 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)-. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)-. Following Lipinski's Rule of Five, Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)- 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 Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)-?
The CAS number of Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)- is 87315-20-6.
What is the molecular formula of Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)-?
The molecular formula of Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)- is C12H16N2O3.
What is the molecular weight of Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)-?
The molecular weight of Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)- is 236.12 g/mol.
Where can I buy Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)-?
You can request a quote for Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Butanamide, 3,3-dimethyl-N-(4-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.