Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)-
TL;DR: Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)- (CAS 107020-32-6) is a chemical compound with molecular formula C19H20O4 and molecular weight 312.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-tert-butylbenzoyl)phenoxy]acetic acid
Also Known As: KST-1A0784, [4-(4-tert-butylbenzoyl)phenoxy]acetic acid, 2-[4-(4-tert-butylbenzoyl)phenoxy]acetic Acid, N-benzyl-N-methylaminomethylphosphonic acid, Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)-
| Molecular Formula | C19H20O4 |
|---|---|
| Molecular Weight | 312.14 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 312.13617 |
| Heavy Atoms | 23 |
| Complexity | 408.0 |
Chemical Identifiers
| CAS Number | 107020-32-6 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OCC(=O)O |
| InChIKey | OJLLXQAAXYNISK-UHFFFAOYSA-N |
Product Overview
Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)- (CAS 107020-32-6), with molecular formula C19H20O4 and molecular weight 312.14 g/mol. IUPAC: 2-[4-(4-tert-butylbenzoyl)phenoxy]acetic acid.
Chemical Property Profile of Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)-
Property Insights of Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)-
The XLogP value of 4.2 indicates that Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)-. Following Lipinski's Rule of Five, Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)- has 1 hydrogen bond donor(s) and 4 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 Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)-?
The CAS number of Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)- is 107020-32-6.
What is the molecular formula of Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)-?
The molecular formula of Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)- is C19H20O4.
What is the molecular weight of Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)-?
The molecular weight of Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)- is 312.14 g/mol.
Where can I buy Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)-?
You can request a quote for Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (4-(4-(1,1-dimethylethyl)benzoyl)phenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.