Glycidyl 4-tert-Butylbenzoate
TL;DR: Glycidyl 4-tert-Butylbenzoate (CAS 59313-58-5) is a chemical compound with molecular formula C14H18O3 and molecular weight 234.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxiran-2-ylmethyl 4-tert-butylbenzoate
Also Known As: Glycidyl 4-tert-Butylbenzoate, oxiran-2-ylmethyl 4-(tert-butyl)benzoate, oxiran-2-ylmethyl 4-tert-butylbenzoate, glycidyl p-t-butylbenzoate, 4-tert-Butylbenzoic Acid Glycidyl Ester
| Molecular Formula | C14H18O3 |
|---|---|
| Molecular Weight | 234.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 234.1256 |
| Heavy Atoms | 17 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 59313-58-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)OCC2CO2 |
| InChIKey | NOWVDELPZQQGIG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Glycidyl 4-tert-Butylbenzoate (CAS 59313-58-5), with molecular formula C14H18O3 and molecular weight 234.13 g/mol. IUPAC: oxiran-2-ylmethyl 4-tert-butylbenzoate.
Chemical Property Profile of Glycidyl 4-tert-Butylbenzoate
Property Insights of Glycidyl 4-tert-Butylbenzoate
The XLogP value of 3.1 indicates that Glycidyl 4-tert-Butylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, Glycidyl 4-tert-Butylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Glycidyl 4-tert-Butylbenzoate 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 Glycidyl 4-tert-Butylbenzoate?
The CAS number of Glycidyl 4-tert-Butylbenzoate is 59313-58-5.
What is the molecular formula of Glycidyl 4-tert-Butylbenzoate?
The molecular formula of Glycidyl 4-tert-Butylbenzoate is C14H18O3.
What is the molecular weight of Glycidyl 4-tert-Butylbenzoate?
The molecular weight of Glycidyl 4-tert-Butylbenzoate is 234.13 g/mol.
Where can I buy Glycidyl 4-tert-Butylbenzoate?
You can request a quote for Glycidyl 4-tert-Butylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glycidyl 4-tert-Butylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Glycidyl 4-tert-Butylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.