Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate
TL;DR: Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate (CAS 152034-52-1) is a chemical compound with molecular formula C13H14O4 and molecular weight 234.0892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate
Also Known As: methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate, methyl4-(2,4-dimethylphenyl)-2,4-dioxobutanoate, methyl 4-(2,4-dimethyl phenyl)-2,4-dioxobutanoate, Methyl 4-(2,4-dimethylphenyl)-2,4-dioxo-butanoate, G19450
Technical Specifications
| Molecular Formula | C13H14O4 |
| Molecular Weight | 234.0892 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 234.0892 Da |
| Heavy Atoms | 17 |
| Complexity | 321.0 |
| SMILES | CC1=CC(=C(C=C1)C(=O)CC(=O)C(=O)OC)C |
| InChIKey | NBMVKWZVBCWVIN-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate
Property Insights of Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate. Following Lipinski's Rule of Five, Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate?
The CAS number of Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate is 152034-52-1.
What is the molecular formula of Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate?
The molecular formula of Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate is C13H14O4.
What is the molecular weight of Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate?
The molecular weight of Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate is 234.0892 g/mol.
Where can I buy Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate?
You can request a quote for Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-(2,4-dimethylphenyl)-2,4-dioxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.