(3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate
TL;DR: (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate (CAS 723256-60-8) is a chemical compound with molecular formula C19H22O3 and molecular weight 298.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate
Also Known As: 3-tert-butyl-4-hydroxyphenyl3,4-dimethylbenzoate, (3-tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate, AN-652/42476657
| Molecular Formula | C19H22O3 |
|---|---|
| Molecular Weight | 298.16 g/mol |
| LogP | 4.52574 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.1569 |
| Heavy Atoms | 22 |
| Complexity | 709.1056 |
Chemical Identifiers
| CAS Number | 723256-60-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)OC2=CC(=C(C=C2)O)C(C)(C)C)C |
Product Overview
(3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate (CAS 723256-60-8), with molecular formula C19H22O3 and molecular weight 298.16 g/mol. IUPAC: (3-tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate.
Chemical Property Profile of (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate
Property Insights of (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate
The XLogP value of 4.52574 indicates that (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate has 1 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 (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate?
The CAS number of (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate is 723256-60-8.
What is the molecular formula of (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate?
The molecular formula of (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate is C19H22O3.
What is the molecular weight of (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate?
The molecular weight of (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate is 298.16 g/mol.
Where can I buy (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate?
You can request a quote for (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for (3-Tert-butyl-4-hydroxyphenyl) 3,4-dimethylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.