![3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one structure](/static/products/556/55682-68-3.png)
3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one
TL;DR: 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one (CAS 55682-68-3) is a chemical compound with molecular formula C18H24O4Si and molecular weight 332.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-3-(2-methylbut-3-en-2-yl)-7-trimethylsilyloxychromen-2-one
Also Known As: 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one, 3-(1,1-Dimethylallyl)scopoletin, TMS derivative, 3- -6-methoxy-7-[ oxy]-2H-1-benzopyran-2-one, 2H-1-Benzopyran-2-one, 3-(1,1-dimethyl-2-propenyl)-6-methoxy-7-[(trimethylsilyl)oxy]-, 3-(1,1-Dimethyl-2-propenyl)-6-methoxy-7-[(trimethylsilyl)oxy]-2H-chromen-2-one
| Molecular Formula | C18H24O4Si |
|---|---|
| Molecular Weight | 332.14 g/mol |
| LogP | 4.4789 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.14438 |
| Heavy Atoms | 23 |
| Complexity | 504.0 |
Chemical Identifiers
| CAS Number | 55682-68-3 |
|---|---|
| SMILES | CC(C)(C=C)C1=CC2=CC(=C(C=C2OC1=O)O[Si](C)(C)C)OC |
| InChIKey | KXZRSMSAEAJWSM-UHFFFAOYSA-N |
Product Overview
3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one (CAS 55682-68-3), with molecular formula C18H24O4Si and molecular weight 332.14 g/mol. IUPAC: 6-methoxy-3-(2-methylbut-3-en-2-yl)-7-trimethylsilyloxychromen-2-one.
Chemical Property Profile of 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one
Property Insights of 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one
The XLogP value of 4.4789 indicates that 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one 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 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one?
The CAS number of 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one is 55682-68-3.
What is the molecular formula of 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one?
The molecular formula of 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one is C18H24O4Si.
What is the molecular weight of 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one?
The molecular weight of 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one is 332.14 g/mol.
Where can I buy 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one?
You can request a quote for 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-6-methoxy-7-[oxy]-2h-1-benzopyran-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.