4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone
TL;DR: 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone (CAS 35816-89-8) is a chemical compound with molecular formula C13H16O2 and molecular weight 204.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]ethanone
Also Known As: 2-Prenyl-4-acetylphenol, 4-Acetyl-2-prenylphenol, Spectrum2_000589, Spectrum3_000661, Spectrum4_001153
| Molecular Formula | C13H16O2 |
|---|---|
| Molecular Weight | 204.12 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.11504 |
| Heavy Atoms | 15 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 35816-89-8 |
|---|---|
| SMILES | CC(=CCC1=C(C=CC(=C1)C(=O)C)O)C |
| InChIKey | QJAPFSSVKIZTMR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone (CAS 35816-89-8), with molecular formula C13H16O2 and molecular weight 204.12 g/mol. IUPAC: 1-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]ethanone.
Chemical Property Profile of 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone
Property Insights of 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone
The XLogP value of 3.2 indicates that 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone 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 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone?
The CAS number of 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone is 35816-89-8.
What is the molecular formula of 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone?
The molecular formula of 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone is C13H16O2.
What is the molecular weight of 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone?
The molecular weight of 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone is 204.12 g/mol.
Where can I buy 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone?
You can request a quote for 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-3-(3-methyl-2-butenyl)acetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.