4-Isopropylphenyl 4-tert-butylbenzoate
TL;DR: 4-Isopropylphenyl 4-tert-butylbenzoate (CAS 304673-62-9) is a chemical compound with molecular formula C20H24O2 and molecular weight 296.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-propan-2-ylphenyl) 4-tert-butylbenzoate
Also Known As: 4-isopropylphenyl 4-tert-butylbenzoate, (4-propan-2-ylphenyl) 4-tert-butylbenzoate, BAS 00581505, 4-(methylethyl)phenyl 4-(tert-butyl)benzoate, 4-tert-Butyl-benzoic acid 4-isopropyl-phenyl ester
| Molecular Formula | C20H24O2 |
|---|---|
| Molecular Weight | 296.18 g/mol |
| LogP | 5.3267 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.17764 |
| Heavy Atoms | 22 |
| Complexity | 628.9026 |
Chemical Identifiers
| CAS Number | 304673-62-9 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C(C)(C)C |
Product Overview
4-Isopropylphenyl 4-tert-butylbenzoate (CAS 304673-62-9), with molecular formula C20H24O2 and molecular weight 296.18 g/mol. IUPAC: (4-propan-2-ylphenyl) 4-tert-butylbenzoate.
Chemical Property Profile of 4-Isopropylphenyl 4-tert-butylbenzoate
Property Insights of 4-Isopropylphenyl 4-tert-butylbenzoate
The XLogP value of 5.3267 indicates that 4-Isopropylphenyl 4-tert-butylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4-Isopropylphenyl 4-tert-butylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Isopropylphenyl 4-tert-butylbenzoate 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 4-Isopropylphenyl 4-tert-butylbenzoate?
The CAS number of 4-Isopropylphenyl 4-tert-butylbenzoate is 304673-62-9.
What is the molecular formula of 4-Isopropylphenyl 4-tert-butylbenzoate?
The molecular formula of 4-Isopropylphenyl 4-tert-butylbenzoate is C20H24O2.
What is the molecular weight of 4-Isopropylphenyl 4-tert-butylbenzoate?
The molecular weight of 4-Isopropylphenyl 4-tert-butylbenzoate is 296.18 g/mol.
Where can I buy 4-Isopropylphenyl 4-tert-butylbenzoate?
You can request a quote for 4-Isopropylphenyl 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 4-Isopropylphenyl 4-tert-butylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-Isopropylphenyl 4-tert-butylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.