4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one
TL;DR: 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one (CAS 87315-06-8) is a chemical compound with molecular formula C17H18O3 and molecular weight 270.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one
Also Known As: 4-methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one, 2H-Pyran-2-one, 3-(1,1-dimethyl-2-propenyl)-4-methoxy-6-phenyl-, 3-(1,1-Dimethyl-2-propenyl)-4-methoxy-6-phenyl-2H-pyran-2-one from Hypericum mysorense, 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenyl-2H-pyran-2-one, 3-(1,1-Dimethyl-2-propenyl)-4-methoxy-6-phenyl- 2H-pyran-2-one from Hypericum mysorense
| Molecular Formula | C17H18O3 |
|---|---|
| Molecular Weight | 270.13 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 270.12558 |
| Heavy Atoms | 20 |
| Complexity | 463.0 |
Chemical Identifiers
| CAS Number | 87315-06-8 |
|---|---|
| SMILES | CC(C)(C=C)C1=C(C=C(OC1=O)C2=CC=CC=C2)OC |
| InChIKey | JHFVOPRTYLFUOK-UHFFFAOYSA-N |
Product Overview
4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one (CAS 87315-06-8), with molecular formula C17H18O3 and molecular weight 270.13 g/mol. IUPAC: 4-methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one.
Chemical Property Profile of 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one
Property Insights of 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one
The XLogP value of 4.1 indicates that 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one has 0 hydrogen bond donor(s) and 3 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-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one?
The CAS number of 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one is 87315-06-8.
What is the molecular formula of 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one?
The molecular formula of 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one is C17H18O3.
What is the molecular weight of 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one?
The molecular weight of 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one is 270.13 g/mol.
Where can I buy 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one?
You can request a quote for 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-3-(2-methylbut-3-en-2-yl)-6-phenylpyran-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.