p-Sec-butylphenyl acetate
TL;DR: p-Sec-butylphenyl acetate (CAS 15733-24-1) is a chemical compound with molecular formula C12H16O2 and molecular weight 192.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-butan-2-ylphenyl) acetate
Also Known As: p-Sec-butylphenyl acetate, 4-Sec-butylphenyl acetate, (4-butan-2-ylphenyl) acetate, 4-Sec-butylphenyl acetate #, 4-(butan-2-yl)phenyl acetate
| Molecular Formula | C12H16O2 |
|---|---|
| Molecular Weight | 192.12 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 192.11504 |
| Heavy Atoms | 14 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 15733-24-1 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)OC(=O)C |
| InChIKey | CECFXTLUSUSYDG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-Sec-butylphenyl acetate (CAS 15733-24-1), with molecular formula C12H16O2 and molecular weight 192.12 g/mol. IUPAC: (4-butan-2-ylphenyl) acetate.
Chemical Property Profile of p-Sec-butylphenyl acetate
Property Insights of p-Sec-butylphenyl acetate
The XLogP value of 3.4 indicates that p-Sec-butylphenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, p-Sec-butylphenyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Sec-butylphenyl acetate has 0 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 p-Sec-butylphenyl acetate?
The CAS number of p-Sec-butylphenyl acetate is 15733-24-1.
What is the molecular formula of p-Sec-butylphenyl acetate?
The molecular formula of p-Sec-butylphenyl acetate is C12H16O2.
What is the molecular weight of p-Sec-butylphenyl acetate?
The molecular weight of p-Sec-butylphenyl acetate is 192.12 g/mol.
Where can I buy p-Sec-butylphenyl acetate?
You can request a quote for p-Sec-butylphenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Sec-butylphenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for p-Sec-butylphenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.