4-Chlorophenyl 2-(4-isobutylphenyl)propanoate
TL;DR: 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate (CAS 69474-23-3) is a chemical compound with molecular formula C19H21ClO2 and molecular weight 316.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl) 2-[4-(2-methylpropyl)phenyl]propanoate
Also Known As: 4-chlorophenyl 2-(4-isobutylphenyl)propanoate, AN-652/42190755, (4-chlorophenyl) 2-[4-(2-methylpropyl)phenyl]propanoate, 4-Chlorophenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate, 4-Chlorophenyl
| Molecular Formula | C19H21ClO2 |
|---|---|
| Molecular Weight | 316.12 g/mol |
| LogP | 5.2476 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.12302 |
| Heavy Atoms | 22 |
| Complexity | 614.88837 |
Chemical Identifiers
| CAS Number | 69474-23-3 |
|---|---|
| SMILES | CC(C)CC1=CC=C(C=C1)C(C)C(=O)OC2=CC=C(C=C2)Cl |
Product Overview
4-Chlorophenyl 2-(4-isobutylphenyl)propanoate (CAS 69474-23-3), with molecular formula C19H21ClO2 and molecular weight 316.12 g/mol. IUPAC: (4-chlorophenyl) 2-[4-(2-methylpropyl)phenyl]propanoate.
Chemical Property Profile of 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate
Property Insights of 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate
The XLogP value of 5.2476 indicates that 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate 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-Chlorophenyl 2-(4-isobutylphenyl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate 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-Chlorophenyl 2-(4-isobutylphenyl)propanoate?
The CAS number of 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate is 69474-23-3.
What is the molecular formula of 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate?
The molecular formula of 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate is C19H21ClO2.
What is the molecular weight of 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate?
The molecular weight of 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate is 316.12 g/mol.
Where can I buy 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate?
You can request a quote for 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for 4-Chlorophenyl 2-(4-isobutylphenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.