![[1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate structure](/static/products/7381/7381-35-3.webp)
[1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate
TL;DR: [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate (CAS 7381-35-3) is a chemical compound with molecular formula C20H22O4 and molecular weight 326.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate
Also Known As: [1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate|1-(2H-1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl phenylacetate|[1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetat
| Molecular Formula | C20H22O4 |
|---|---|
| Molecular Weight | 326.15 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 326.1518 |
| Heavy Atoms | 24 |
| Complexity | 422.0 |
Chemical Identifiers
| CAS Number | 7381-35-3 |
|---|---|
| SMILES | CC(C)(C)C(C1=CC2=C(C=C1)OCO2)OC(=O)CC3=CC=CC=C3 |
| InChIKey | VCBDMHXCXZSWNR-UHFFFAOYSA-N |
Product Overview
[1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate (CAS 7381-35-3), with molecular formula C20H22O4 and molecular weight 326.15 g/mol. IUPAC: [1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate.
Chemical Property Profile of [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate
Property Insights of [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate
The XLogP value of 4.8 indicates that [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate has 0 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 [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate?
The CAS number of [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate is 7381-35-3.
What is the molecular formula of [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate?
The molecular formula of [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate is C20H22O4.
What is the molecular weight of [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate?
The molecular weight of [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate is 326.15 g/mol.
Where can I buy [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate?
You can request a quote for [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate?
Yes, KEHONG BIO provides custom synthesis services for [1-(1,3-Benzodioxol-5-yl)-2,2-dimethylpropyl] 2-phenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.