![Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]- structure](/static/products/132/132991-25-4.png)
Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]-
TL;DR: Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]- (CAS 132991-25-4) 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.
4-[[4-(2-methylbutan-2-yl)phenoxy]methyl]benzoic acid
Also Known As: Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]-, 4-[[4-(1,1-Dimethylpropyl)phenoxy]methyl]benzoic acid, 4-[[4-(2-methylbutan-2-yl)phenoxy]methyl]benzoic Acid, 4-{[4-(2-Methylbutan-2-yl)phenoxy]methyl}benzoic acid
| Molecular Formula | C19H22O3 |
|---|---|
| Molecular Weight | 298.16 g/mol |
| LogP | 4.6514 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.1569 |
| Heavy Atoms | 22 |
| Complexity | 624.7348 |
Chemical Identifiers
| CAS Number | 132991-25-4 |
|---|---|
| SMILES | CCC(C)(C)C1=CC=C(C=C1)OCC2=CC=C(C=C2)C(=O)O |
Product Overview
Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]- (CAS 132991-25-4), with molecular formula C19H22O3 and molecular weight 298.16 g/mol. IUPAC: 4-[[4-(2-methylbutan-2-yl)phenoxy]methyl]benzoic acid.
Chemical Property Profile of Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]-
Property Insights of Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]-
The XLogP value of 4.6514 indicates that Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]- has 1 hydrogen bond donor(s) and 2 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 Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]-?
The CAS number of Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]- is 132991-25-4.
What is the molecular formula of Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]-?
The molecular formula of Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]- is C19H22O3.
What is the molecular weight of Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]-?
The molecular weight of Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]- is 298.16 g/mol.
Where can I buy Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]-?
You can request a quote for Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-[[4-(1,1-dimethylpropyl)phenoxy]methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.