(3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one
TL;DR: (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one (CAS 138350-80-8) is a chemical compound with molecular formula C14H16O4 and molecular weight 248.10486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one
Also Known As: Codeine-N-oxide
Technical Specifications
| Molecular Formula | C14H16O4 |
| Molecular Weight | 248.10486 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.10486 Da |
| Heavy Atoms | 18 |
| Complexity | 337.0 |
| SMILES | CCC/C=C\1/C2=C(C(=C(C=C2)OC)OC)C(=O)O1 |
| InChIKey | CUEMNNLTIOIMRI-POHAHGRESA-N |
Chemical Property Profile of (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one
Property Insights of (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one
The XLogP value of 3.1 indicates that (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-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, (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-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
What is the CAS number of (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one?
The CAS number of (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one is 138350-80-8.
What is the molecular formula of (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one?
The molecular formula of (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one is C14H16O4.
What is the molecular weight of (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one?
The molecular weight of (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one is 248.10486 g/mol.
Where can I buy (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one?
You can request a quote for (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one?
Yes, CoreyChem provides custom synthesis services for (3Z)-3-butylidene-6,7-dimethoxy-2-benzofuran-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.