N-(2,4-dimethylphenyl)-2-oxobutanamide
TL;DR: N-(2,4-dimethylphenyl)-2-oxobutanamide (CAS 5358-06-5) is a chemical compound with molecular formula C12H15NO2 and molecular weight 205.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dimethylphenyl)-2-oxobutanamide
Also Known As: Acetoacet-m-xylidide, Acetoaceto-m-xylidide, Acetoacetyl-m-xylidide, 2,4-Acetoacetxylidide, 2,4-Acetoacetoxylidide
| Molecular Formula | C12H15NO2 |
|---|---|
| Molecular Weight | 205.11 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.11028 |
| Heavy Atoms | 15 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 5358-06-5 |
|---|---|
| SMILES | CCC(=O)C(=O)NC1=C(C=C(C=C1)C)C |
| InChIKey | RQQWEUPXOSJYBV-UHFFFAOYSA-N |
Product Overview
N-(2,4-dimethylphenyl)-2-oxobutanamide (CAS 5358-06-5), with molecular formula C12H15NO2 and molecular weight 205.11 g/mol. IUPAC: N-(2,4-dimethylphenyl)-2-oxobutanamide.
Chemical Property Profile of N-(2,4-dimethylphenyl)-2-oxobutanamide
Property Insights of N-(2,4-dimethylphenyl)-2-oxobutanamide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,4-dimethylphenyl)-2-oxobutanamide. With a topological polar surface area (TPSA) of 46.2 Ų, N-(2,4-dimethylphenyl)-2-oxobutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2,4-dimethylphenyl)-2-oxobutanamide has 1 hydrogen bond donor(s) and 2 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-(2,4-dimethylphenyl)-2-oxobutanamide?
The CAS number of N-(2,4-dimethylphenyl)-2-oxobutanamide is 5358-06-5.
What is the molecular formula of N-(2,4-dimethylphenyl)-2-oxobutanamide?
The molecular formula of N-(2,4-dimethylphenyl)-2-oxobutanamide is C12H15NO2.
What is the molecular weight of N-(2,4-dimethylphenyl)-2-oxobutanamide?
The molecular weight of N-(2,4-dimethylphenyl)-2-oxobutanamide is 205.11 g/mol.
Where can I buy N-(2,4-dimethylphenyl)-2-oxobutanamide?
You can request a quote for N-(2,4-dimethylphenyl)-2-oxobutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4-dimethylphenyl)-2-oxobutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-dimethylphenyl)-2-oxobutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.