(4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate
TL;DR: (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate (CAS 685848-08-2) is a chemical compound with molecular formula C19H20O3 and molecular weight 296.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-benzoyl-2-methylphenyl) 2,2-dimethylpropanoate
Also Known As: 4-benzoyl-2-methylphenyl pivalate, 4-benzoyl-2-tolyl 2,2-dimethylpropionate, (4-benzoyl-2-methylphenyl) 2,2-dimethylpropanoate, 4-BENZOYL-2-METHYLPHENYL 2,2-DIMETHYLPROPANOATE, VU0509192-1
| Molecular Formula | C19H20O3 |
|---|---|
| Molecular Weight | 296.14 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.14124 |
| Heavy Atoms | 22 |
| Complexity | 401.0 |
Chemical Identifiers
| CAS Number | 685848-08-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(=O)C2=CC=CC=C2)OC(=O)C(C)(C)C |
| InChIKey | KXFKARSPTYFZCH-UHFFFAOYSA-N |
Product Overview
(4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate (CAS 685848-08-2), with molecular formula C19H20O3 and molecular weight 296.14 g/mol. IUPAC: (4-benzoyl-2-methylphenyl) 2,2-dimethylpropanoate.
Chemical Property Profile of (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate
Property Insights of (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate
The XLogP value of 4.8 indicates that (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate has 0 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 (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate?
The CAS number of (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate is 685848-08-2.
What is the molecular formula of (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate?
The molecular formula of (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate is C19H20O3.
What is the molecular weight of (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate?
The molecular weight of (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate is 296.14 g/mol.
Where can I buy (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate?
You can request a quote for (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Benzoyl-2-methylphenyl) 2,2-dimethylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.