3,5-Dimethylphenyl 2,4,6-trimethylbenzoate
TL;DR: 3,5-Dimethylphenyl 2,4,6-trimethylbenzoate (CAS 304673-87-8) is a chemical compound with molecular formula C18H20O2 and molecular weight 268.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-dimethylphenyl) 2,4,6-trimethylbenzoate
Also Known As: 3,5-dimethylphenyl 2,4,6-trimethylbenzoate, (3,5-dimethylphenyl) 2,4,6-trimethylbenzoate
| Molecular Formula | C18H20O2 |
|---|---|
| Molecular Weight | 268.15 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.14633 |
| Heavy Atoms | 20 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 304673-87-8 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OC(=O)C2=C(C=C(C=C2C)C)C)C |
| InChIKey | RENUVPZVFQDKNK-UHFFFAOYSA-N |
Product Overview
3,5-Dimethylphenyl 2,4,6-trimethylbenzoate (CAS 304673-87-8), with molecular formula C18H20O2 and molecular weight 268.15 g/mol. IUPAC: (3,5-dimethylphenyl) 2,4,6-trimethylbenzoate.
Chemical Property Profile of 3,5-Dimethylphenyl 2,4,6-trimethylbenzoate
Property Insights of 3,5-Dimethylphenyl 2,4,6-trimethylbenzoate
The XLogP value of 5.2 indicates that 3,5-Dimethylphenyl 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, 3,5-Dimethylphenyl 2,4,6-trimethylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethylphenyl 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 3,5-Dimethylphenyl 2,4,6-trimethylbenzoate?
The CAS number of 3,5-Dimethylphenyl 2,4,6-trimethylbenzoate is 304673-87-8.
What is the molecular formula of 3,5-Dimethylphenyl 2,4,6-trimethylbenzoate?
The molecular formula of 3,5-Dimethylphenyl 2,4,6-trimethylbenzoate is C18H20O2.
What is the molecular weight of 3,5-Dimethylphenyl 2,4,6-trimethylbenzoate?
The molecular weight of 3,5-Dimethylphenyl 2,4,6-trimethylbenzoate is 268.15 g/mol.
Where can I buy 3,5-Dimethylphenyl 2,4,6-trimethylbenzoate?
You can request a quote for 3,5-Dimethylphenyl 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 3,5-Dimethylphenyl 2,4,6-trimethylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethylphenyl 2,4,6-trimethylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.