Mesityl 2,4,6-trimethylbenzoate
TL;DR: Mesityl 2,4,6-trimethylbenzoate (CAS 1504-38-7) is a chemical compound with molecular formula C19H22O2 and molecular weight 282.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4,6-trimethylphenyl) 2,4,6-trimethylbenzoate
Also Known As: Mesityl 2,4,6-trimethylbenzoate, 2,4,6-TRIMETHYLPHENYL 2,4,6-TRIMETHYLBENZOATE, Benzoic acid, 2,4,6-trimethyl-, 2,4,6-trimethylphenyl ester, (2,4,6-trimethylphenyl) 2,4,6-trimethylbenzoate, Mesityl 2,4,6-trimethylbenzoate #
| Molecular Formula | C19H22O2 |
|---|---|
| Molecular Weight | 282.16 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.162 |
| Heavy Atoms | 21 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 1504-38-7 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)C(=O)OC2=C(C=C(C=C2C)C)C)C |
| InChIKey | FAWKUOSTOPFSTA-UHFFFAOYSA-N |
Product Overview
Mesityl 2,4,6-trimethylbenzoate (CAS 1504-38-7), with molecular formula C19H22O2 and molecular weight 282.16 g/mol. IUPAC: (2,4,6-trimethylphenyl) 2,4,6-trimethylbenzoate.
Chemical Property Profile of Mesityl 2,4,6-trimethylbenzoate
Property Insights of Mesityl 2,4,6-trimethylbenzoate
The XLogP value of 5.5 indicates that Mesityl 2,4,6-trimethylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Mesityl 2,4,6-trimethylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mesityl 2,4,6-trimethylbenzoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Mesityl 2,4,6-trimethylbenzoate?
The CAS number of Mesityl 2,4,6-trimethylbenzoate is 1504-38-7.
What is the molecular formula of Mesityl 2,4,6-trimethylbenzoate?
The molecular formula of Mesityl 2,4,6-trimethylbenzoate is C19H22O2.
What is the molecular weight of Mesityl 2,4,6-trimethylbenzoate?
The molecular weight of Mesityl 2,4,6-trimethylbenzoate is 282.16 g/mol.
Where can I buy Mesityl 2,4,6-trimethylbenzoate?
You can request a quote for Mesityl 2,4,6-trimethylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mesityl 2,4,6-trimethylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Mesityl 2,4,6-trimethylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.